Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10662007 | 0.83 | ALDH1A1 (0.39) | CYP1A2CYP2C9CYP2C19KDM4ENPSR1 | |
| SCHEMBL10657373 | 0.81 | POLB (0.36) | CYP1A2CYP2D6CYP2C9CYP2C19KDM4E | |
| SCHEMBL10658752 | 0.81 | EPHB4 (0.45) | CYP1A2CYP2C9CYP2C19ALDH1A1LMNA | |
| SCHEMBL10659049 | 0.80 | HPGD (0.35) | KDM4EALDH1A1HPGDLMNAEPHB4 | |
| SCHEMBL10377111 | 0.77 | MAPT (0.47) | CYP1A2CYP2C19KDM4EALDH1A1HPGD | |
| SCHEMBL10657589 | 0.76 | MAPT (0.39) | CYP1A2CYP2D6CYP2C9CYP2C19KDM4E | |
| SCHEMBL9628920 | 0.74 | MAPT (0.46) | CYP1A2CYP2C19KDM4EALDH1A1HPGD | |
| SCHEMBL10656144 | 0.74 | POLB (0.38) | CYP1A2CYP2D6CYP2C9CYP2C19KDM4E | |
| SCHEMBL10660728 | 0.74 | KDM4E (0.41) | KDM4EALDH1A1RXFP1LMNATP53 | |
| SCHEMBL10659042 | 0.73 | EPHB4 (0.34) | KDM4EALDH1A1HPGDEPHB4GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4740511-A | ANTIALLERGENS, ANTIINFLAMMATORY, ANTIULCER AGENTS | SCHERING CORPORATION (US) | 1988-04-26 | — | — | US | disclosed |
| US-4680298-A | Tricyclic anti-allergy and use as anti-inflammatory agents | SCHERING CORPORATION (US) | 1987-07-14 | — | — | US | disclosed |
| US-4680297-A | Tricyclic positive inotropic agents | SCHERING CORPORATION (US) | 1987-07-14 | — | — | US | disclosed |
| EP-0127135-A2 | Fused tricyclic derivatives of naphthyridinone and pyridone and the corresponding thiones | SCHERING CORPORATION (US) | 1984-12-05 | — | — | EP | disclosed |