Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1760417 | 0.68 | CNR1 (0.50) | CNR1CNR2 | |
| SCHEMBL30027246 | 0.68 | CNR1 (0.50) | CNR1CNR2 | |
| SCHEMBL69199 | 0.64 | HPGD (0.41) | CNR1CNR2 | |
| SCHEMBL6235059 | 0.63 | CNR1 (0.42) | TP53CYP1A2CNR1CNR2 | |
| SCHEMBL9722365 | 0.62 | TP53 (0.33) | TP53CYP1A2CNR1CNR2 | |
| SCHEMBL6573311 | 0.62 | CNR1 (0.41) | CNR1CNR2 | |
| SCHEMBL15255041 | 0.61 | CNR1 (0.43) | CNR1CNR2 | |
| SCHEMBL6545337 | 0.60 | ADAMTS4 (0.30) | — | |
| SCHEMBL23387417 | 0.59 | NOS2 (0.42) | CYP1A2CNR1CNR2 | |
| SCHEMBL981537 | 0.59 | PRKCI (0.48) | TP53CNR1CNR2 |
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-1265848-A2 | AMINES SUBSTITUTED WITH A DIHYDRONAPHTHALENYL, CRHOMENYL, OR THIOCHROMENYL GROUP, AN ARYL OR HETEROARYL GROUP AND AN ALKYL GROUP, HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | Allergan Sales, Inc. (US) | 2002-12-18 | — | — | EP | disclosed |
| WO-2001070668-A2 | AMINES SUBSTITUTED WITH A DIHYDRONAPHTHALENYL, CRHOMENYL, OR THIOCHROMENYL GROUP, AN ARYL OR HETEROARYL GROUP AND AN ALKYL GROUP, HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN, INC. (US) | 2001-09-27 | — | — | WO | disclosed |