Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7894510 | 1.00 | CYP19A1 (0.51) | CYP19A1PTGS2AKR1C3AKR1C2 | |
| SCHEMBL7898781 | 0.91 | NHERF1 (0.47) | CYP19A1PTGS2AKR1C3 | |
| SCHEMBL7898784 | 0.91 | NHERF1 (0.47) | CYP19A1PTGS2AKR1C3 | |
| SCHEMBL8155346 | 0.91 | PTGS2 (0.53) | CYP19A1PTGS2 | |
| SCHEMBL8155347 | 0.91 | PTGS2 (0.53) | CYP19A1PTGS2 | |
| SCHEMBL7895226 | 0.90 | PTGS2 (0.45) | CYP19A1PTGS2 | |
| SCHEMBL7895227 | 0.90 | PTGS2 (0.45) | CYP19A1PTGS2 | |
| SCHEMBL7894395 | 0.88 | AKR1C3 (0.45) | PTGS2AKR1C3 | |
| SCHEMBL7894390 | 0.88 | AKR1C3 (0.45) | PTGS2AKR1C3 | |
| SCHEMBL7898845 | 0.88 | AKR1C3 (0.47) | CYP19A1PTGS2AKR1C3AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6180651-B1 | ANTIINFLAMMATORY AGENTS; ANALGESICS | BRISTOL-MYERS SQUIBB | 2001-01-30 | — | — | US | disclosed |
| WO-2000014082-A1 | DIARYLMETHYLIDENE FURAN DERIVATIVES AS DRUGS WITH ANTI-INFLAMMATORY, ANALGESIC AND CHEMOPREVENTIVE PROPERTIES | LABORATORIES UPSA (FR) | 2000-03-16 | — | — | WO | disclosed |
| US-5807873-A | Diarylmethylidenefuran derivatives and their uses in therapeutics | LABORATORIES UPSA (FR) | 1998-09-15 | — | — | US | disclosed |