Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 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 | |
|---|---|---|---|---|
| SCHEMBL9250332 | 0.76 | CA2 (0.47) | ALDH1A1TSHR | |
| SCHEMBL15524912 | 0.73 | HRH3 (0.41) | TRPA1ALDH1A1TSHRCES2CES1 | |
| SCHEMBL29268172 | 0.70 | TRPA1 (0.40) | TRPA1ALDH1A1TSHRCES2CES1 | |
| SCHEMBL5280539 | 0.68 | LMNA (0.57) | ALDH1A1 | |
| SCHEMBL22027005 | 0.67 | LMNA (0.54) | — | |
| SCHEMBL14166006 | 0.67 | AKR1C1 (0.50) | TRPA1ALDH1A1TSHRCES2CES1 | |
| SCHEMBL131361 | 0.66 | ALDH1A1 (0.67) | TRPA1ALDH1A1TSHRCES2CES1 | |
| SCHEMBL4680071 | 0.64 | AKR1C1 (0.61) | TSHRCES2CES1 | |
| SCHEMBL12982189 | 0.64 | TSHR (0.34) | TRPA1ALDH1A1TSHR | |
| SCHEMBL118612 | 0.64 | OPRM1 (0.44) | — |
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-0599732-B1 | Derivatives of 1-phenylbicyclo-2,2,2-octane, their preparation process and pharmaceutical compositions containing them | ADIR (FR) | 1997-03-12 | — | — | EP | disclosed |
| US-5403953-A | Antiarthritic and -inflammatory agents | ADIR ET COMPAGNIE (FR) | 1995-04-04 | — | — | US | disclosed |
| EP-0599732-A1 | Derivatives of 1-phenylbicyclo-2,2,2-octane, their preparation process and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1994-06-01 | — | — | EP | disclosed |