Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 19/20 | 0.62 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5203055 | 1.00 | PTGS2 (0.62) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL6887276 | 0.95 | PTGS2 (0.59) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL5865485 | 0.91 | PTGS2 (0.64) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL5205021 | 0.90 | PTGS2 (0.57) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL6880090 | 0.89 | PTGS2 (0.53) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL5236686 | 0.89 | PTGS2 (0.53) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL6885219 | 0.89 | PTGS2 (0.57) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL5204574 | 0.89 | PTGS2 (0.63) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL6884935 | 0.89 | PTGS2 (0.53) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL5202252 | 0.89 | PTGS2 (0.53) | PTGS2PTGS1CYP2C9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6803380-B1 | NON-STEROIDAL ANTIINFLAMMATORY DRUGS | LABORATOIRE THERAMEX (MC) | 2004-10-12 | — | — | US | disclosed |
| EP-1246809-B1 | 5-ARYL-1H-1,2,4-TRIAZOLE COMPOUNDS AS INHIBITORS OF CYCLOOXYGENASE-2 AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | THERAMEX (MC) | 2003-07-16 | — | — | EP | disclosed |
| EP-1246809-A1 | 5-ARYL-1H-1,2,4-TRIAZOLE COMPOUNDS AS INHIBITORS OF CYCLOOXYGENASE-2 AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LABORATOIRE THERAMEX (MC) | 2002-10-09 | — | — | EP | disclosed |
| WO-2001034577-A1 | 5-ARYL-1H-1,2,4-TRIAZOLE COMPOUNDS AS INHIBITORS OF CYCLOOXYGENASE-2 AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LABORATOIRE THERAMEX (MC) | 2001-05-17 | — | — | WO | disclosed |
| EP-1099695-A1 | 5-aryl-1H-1,2,4-triazole compounds as inhibitors of cyclooxygenase-2 and pharmaceutical compositions containing them | LABORATOIRE THERAMEX S.A. (MC) | 2001-05-16 | — | — | EP | disclosed |