Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 6/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8015171 | 1.00 | OPRL1 (0.33) | OPRL1CYP2C9PTGS2PTGS1ALDH1A1 | |
| SCHEMBL8015169 | 1.00 | OPRL1 (0.33) | OPRL1CYP2C9PTGS2PTGS1ALDH1A1 | |
| SCHEMBL9008542 | 1.00 | OPRL1 (0.33) | OPRL1CYP2C9PTGS2PTGS1ALDH1A1 | |
| SCHEMBL8006030 | 0.90 | CYP2C9 (0.31) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8006036 | 0.90 | CYP2C9 (0.31) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL9008528 | 0.90 | CYP2C9 (0.31) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8006033 | 0.90 | CYP2C9 (0.31) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8019221 | 0.87 | KDM1A (0.32) | — | |
| SCHEMBL9008569 | 0.87 | KDM1A (0.32) | — | |
| SCHEMBL8019225 | 0.87 | KDM1A (0.32) | — |
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-0670322-B1 | A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it | SHINETSU CHEMICAL CO (JP) | 2000-01-19 | — | — | EP | disclosed |
| US-5582764-A | Silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-12-10 | — | — | US | disclosed |
| EP-0670322-A1 | A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it | Shin-Etsu Chemical Co., Ltd. (JP) | 1995-09-06 | — | — | EP | disclosed |