Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL992080 | 0.78 | MAPK1 (0.50) | CYP2C19MAPK1 | |
| SCHEMBL991402 | 0.72 | KDM4E (0.44) | MAPK1 | |
| SCHEMBL17342897 | 0.64 | VNN1 (0.33) | — | |
| SCHEMBL12775521 | 0.63 | MAPK1 (0.49) | CYP2C19MAPK1 | |
| SCHEMBL16583134 | 0.62 | MAPK1 (0.44) | CYP2C19MAPK1 | |
| SCHEMBL31292464 | 0.60 | CYP2C19 (0.44) | CYP2C19MAPK1 | |
| SCHEMBL9589700 | 0.60 | CYP19A1 (0.40) | — | |
| SCHEMBL18068056 | 0.60 | CYP3A4 (0.34) | CYP2C19 | |
| SCHEMBL28092254 | 0.59 | — | — | |
| SCHEMBL14903856 | 0.59 | PKM (0.42) | CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2665732-B1 | FUSED AMINODIHYDROTHIAZINE DERIVATIVES USEFUL AS BACE INHIBITORS | EISAI R&D MAN CO LTD (JP) | 2016-03-30 | — | — | EP | disclosed |