Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 19/20 | 0.72 |
| ▸ | PTGS1 | P23219 | 17/20 | 0.72 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8388589 | 0.94 | PTGS2 (0.74) | PTGS2PTGS1 | |
| SCHEMBL8386025 | 0.94 | PTGS2 (0.69) | PTGS2PTGS1 | |
| SCHEMBL8386271 | 0.85 | PTGS2 (0.74) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL8387320 | 0.84 | PTGS2 (0.74) | PTGS2PTGS1 | |
| SCHEMBL8385148 | 0.84 | PTGS2 (0.72) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL8384214 | 0.84 | PTGS2 (1.00) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL8384274 | 0.84 | PTGS2 (0.72) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL8384371 | 0.84 | PTGS2 (0.74) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL8387685 | 0.84 | PTGS2 (0.72) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL213644 | 0.84 | PTGS2 (1.00) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0743938-B1 | SUBSTITUTED SPIRO COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 1999-04-21 | — | — | EP | disclosed |
| US-5393790-A | Diphenyl- or phenyl/pyridyl-substituted spiroheptenes, -octenes,-nonenes or -decenes; cyclooxygenase II inhibitors; side effect reduction; antipyretics; antiarthritic agents | G.D. SEARLE & CO. (US) | 1995-02-28 | — | — | US | disclosed |