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 | |
|---|---|---|---|---|
| 5-Hydroxy Rofecoxib SCHEMBL6331980 | 0.89 | PTGS2 (1.00) | PTGS2PTGS1 | |
| SCHEMBL6330216 | 0.86 | PTGS2 (0.70) | PTGS2PTGS1 | |
| SCHEMBL6742689 | 0.74 | PTGS2 (0.47) | PTGS2PTGS1 | |
| SCHEMBL21675747 | 0.73 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL6672818 | 0.73 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL6348979 | 0.72 | PTGS2 (0.71) | PTGS2PTGS1 | |
| SCHEMBL6598211 | 0.72 | PTGS2 (0.71) | PTGS2PTGS1 | |
| SCHEMBL21675748 | 0.72 | PTGS2 (0.71) | PTGS2PTGS1 | |
| SCHEMBL7958864 | 0.72 | PTGS2 (0.70) | PTGS2PTGS1 | |
| SCHEMBL6330736 | 0.72 | PTGS2 (0.53) | PTGS2PTGS1 |
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-0975604-B1 | PYRIDAZINONES AS INHIBITORS OF CYCLOOXYGENASE-2 | MERCK FROSST CANADA INC (CA) | 2004-07-21 | — | — | EP | disclosed |
| EP-0975604-A1 | PYRIDAZINONES AS INHIBITORS OF CYCLOOXYGENASE-2 | Merck Frosst Canada & Co. (CA) | 2000-02-02 | — | — | EP | disclosed |
| US-6004960-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS; ANTIPYRETICS, ANALGESICS; SIDE EFFECT REDUCTION | MERCK FROSST CANADA, INC. (CA) | 1999-12-21 | — | — | US | disclosed |
| WO-1998041511-A1 | PYRIDAZINONES AS INHIBITORS OF CYCLOOXYGENASE-2 | MERCK FROSST CANADA & CO. (CA) | 1998-09-24 | — | — | WO | disclosed |