Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL6326345 | 0.83 | PTGS1 (0.34) | PTGS1PTGS2 | |
| SCHEMBL7568017 | 0.72 | PTGS1 (0.47) | PTGS1PTGS2 | |
| SCHEMBL72613 | 0.72 | AR (0.43) | — | |
| SCHEMBL7567949 | 0.71 | PTGS1 (0.44) | PTGS1PTGS2 | |
| SCHEMBL7569141 | 0.69 | PTGS1 (0.37) | PTGS1PTGS2 | |
| SCHEMBL7565479 | 0.69 | PTGS2 (0.35) | PTGS1PTGS2 | |
| SCHEMBL7573867 | 0.67 | PTGS1 (0.47) | PTGS1PTGS2 | |
| SCHEMBL7565527 | 0.66 | PTGS2 (0.51) | PTGS1PTGS2 | |
| SCHEMBL7566050 | 0.66 | ALDH2 (0.32) | — | |
| SCHEMBL10472855 | 0.65 | HSD17B1 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0889878-B1 | BISARYLCYCLOBUTENE DERIVATES AS CYCLOOXYGENASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2002-09-04 | — | — | EP | disclosed |
| EP-0889878-A1 | BISARYLCYCLOBUTENE DERIVATES AS CYCLOOXYGENASE INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1999-01-13 | — | — | EP | disclosed |
| US-5817700-A | ANTIINFLAMMATORY AGENTS | MERCK FROSST CANADA, INC. (CA) | 1998-10-06 | — | — | US | disclosed |
| WO-1997036863-A1 | BISARYLCYCLOBUTENE DERIVATES AS CYCLOOXYGENASE INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1997-10-09 | — | — | WO | disclosed |