Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7759925 | 1.00 | CYP2C9 (0.41) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL8416897 | 1.00 | CYP2C9 (0.41) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL7758052 | 0.88 | CYP2C9 (0.43) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL8417319 | 0.88 | CYP2C9 (0.43) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL7758058 | 0.88 | CYP2C9 (0.43) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL7761176 | 0.85 | CYP2C9 (0.40) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL8415908 | 0.85 | CYP2C9 (0.40) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL7761177 | 0.85 | CYP2C9 (0.40) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL7759571 | 0.84 | CYP2C9 (0.36) | CYP2C9ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL7759574 | 0.84 | CYP2C9 (0.36) | CYP2C9ESR2ALDH1A1LMNAMAPT |
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-0711777-B1 | Cyclohexanone compounds, a process for preparing the cyclohexanone compounds, and a process for preparing silacyclohexane-based compounds from the cyclohexanone compounds | SHINETSU CHEMICAL CO (JP) | 2001-04-04 | — | — | EP | disclosed |
| EP-0711777-A1 | Cyclohexanone compounds, a process for preparing the cyclohexanone compounds, and a process for preparing silacyclohexane-based compounds from the cyclohexanone compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-05-15 | — | — | EP | disclosed |