Path loss (PL) is an essential parameter in propagation models and critical in determining mobile systems coverage area. Machine learning (ML) methods have become promising tools for radio propagation prediction. However, there are still some challenges for its full deployment, concerning to selection of the most significant model s inputs, understanding their contributions to the model s predictions, and a further evaluation of the generalization capacity for unknown samples. This thesis aims to design optimized ML-based PL models for different applications for the 5G and beyond technologies. These applications encompass millimeter wave (mmWave) links for indoor and outdoor environments in the frequency band from 26.5 to 40 GHz, macrocell coverage in the sub-6 GHz spectrum, and vehicular communications using measurements campaign carried out by the Laboratory of Radio-propagation, CETUC, in Rio de Janeiro, Brazil. Several ML algorithms are exploited, such as artificial neural network (ANN), support vector regression (SVR), random forest (RF), and gradient tree boosting (GTB). Furthermore, we have extended two empirical models for mmWave with improved PL prediction. We proposes a methodology for robust ML model selection and a methodology to select the most suitable predictors for the machines considered based on performance improvement and the model s interpretability. In adittion, for the vehicle-to-vehicle (V2V) channel, a convolutional neural network (CNN) technique is also proposed using a transfer learning approach to deal with small datasets. The generalization tests proposed shows the ability of the ML models to learn the pattern between the model’s inputs and PL, even in more challenging environments and scenarios of unknown samples.