Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | MYB | P10242 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19620595 | 0.90 | KCNA5 (0.36) | KDM4EPOLBMAPTSLC6A2SLC6A4 | |
| SCHEMBL19620645 | 0.90 | KDM4E (0.36) | KDM4EPOLBMAPT | |
| SCHEMBL15627599 | 0.85 | KDM4E (0.41) | KDM4EPOLBMAPT | |
| SCHEMBL20367974 | 0.85 | MAPT (0.41) | KDM4EPOLBMAPT | |
| SCHEMBL20368252 | 0.84 | MAPT (0.39) | KDM4EPOLBMAPT | |
| SCHEMBL22902083 | 0.84 | KDM4E (0.39) | KDM4EPOLBMAPT | |
| SCHEMBL19620541 | 0.84 | KDM4E (0.37) | KDM4EPOLBMAPT | |
| SCHEMBL19620538 | 0.84 | KDM4E (0.37) | KDM4EPOLBMAPT | |
| SCHEMBL19620529 | 0.83 | DPP4 (0.33) | — | |
| SCHEMBL19620621 | 0.83 | MAPT (0.49) | KDM4EPOLBMAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3345596-A2 | INHIBITORS OF BETA-HYDROLASE FOR TREATMENT OF CANCER | RHODE ISLAND HOSPITAL (US) | 2018-07-11 | — | — | EP | disclosed |
| EP-2897607-B1 | INHIBITORS OF BETA-HYDROLASE FOR TREATMENT OF CANCER | RHODE ISLAND HOSPITAL (US) | 2017-11-22 | — | — | EP | disclosed |