Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8518013 | 0.95 | TDP1 (0.44) | TDP1L3MBTL1PPARACYP19A1CYP3A4 | |
| SCHEMBL8517789 | 0.95 | TDP1 (0.44) | TDP1L3MBTL1PPARACYP19A1CYP3A4 | |
| SCHEMBL8517447 | 0.83 | CYP3A4 (0.37) | TDP1L3MBTL1CYP19A1CYP3A4CYP2D6 | |
| SCHEMBL8517952 | 0.78 | CYP3A4 (0.36) | TDP1L3MBTL1CYP19A1CYP3A4CYP2D6 | |
| SCHEMBL8518169 | 0.78 | CYP3A4 (0.36) | TDP1L3MBTL1CYP19A1CYP3A4CYP2D6 | |
| SCHEMBL7601556 | 0.71 | SCD (0.39) | CYP3A4ALDH1A1LMNA | |
| SCHEMBL8518186 | 0.70 | CYP1A2 (0.39) | CYP19A1CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL8518371 | 0.70 | CYP1A2 (0.39) | CYP19A1CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL1023426 | 0.69 | PTGS1 (0.48) | TDP1L3MBTL1PPARACYP19A1CYP3A4 | |
| SCHEMBL9235176 | 0.68 | TDP1 (0.47) | TDP1L3MBTL1PPARACYP19A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0743938-B1 | SUBSTITUTED SPIRO COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 1999-04-21 | — | — | EP | disclosed |
| WO-1995030652-A1 | SUBSTITUTED SPIRODIENES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1995-11-16 | — | — | WO | 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 |