Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 20/20 | 0.60 |
| ▸ | RARB | P10826 | 20/20 | 0.60 |
| ▸ | RARG | P13631 | 20/20 | 0.60 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6593231 | 0.88 | RARA (0.67) | RARARARBRARGCYP26A1CYP3A4 | |
| SCHEMBL6592317 | 0.88 | RARA (0.56) | RARARARBRARGCYP26A1CYP3A4 | |
| SCHEMBL6590162 | 0.86 | RARA (0.46) | RARARARBRARGCYP3A4 | |
| SCHEMBL6596504 | 0.85 | RARA (0.60) | RARARARBRARGCYP26A1CYP3A4 | |
| SCHEMBL6594110 | 0.85 | RARB (0.60) | RARARARBRARGCYP26A1CYP3A4 | |
| SCHEMBL8329422 | 0.85 | RARA (0.44) | RARARARBRARG | |
| SCHEMBL8329424 | 0.83 | RARA (0.42) | RARARARBRARG | |
| SCHEMBL24727736 | 0.82 | RARA (0.52) | RARARARBRARG | |
| SCHEMBL6591582 | 0.79 | RARA (0.60) | RARARARBRARGCYP26A1CYP3A4 | |
| SCHEMBL12365915 | 0.78 | RARA (0.59) | RARARARBRARG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1042313-B1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES HAVING RETINOID ANTAGONIST LIKE ACTIVITY | ALLERGAN INC (US) | 2004-04-28 | — | — | EP | disclosed |
| EP-1042313-A1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES HAVING RETINOID ANTAGONIST LIKE ACTIVITY | Allergan Sales, Inc. (US) | 2000-10-11 | — | — | EP | disclosed |
| WO-1999033821-A1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES HAVING RETINOID ANTAGONIST-LIKE ACTIVITY | ALLERGAN SALES, INC. (US) | 1999-07-08 | — | — | WO | disclosed |