Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.45 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TOP2A | P11388 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8084483 | 0.90 | SMN1; SMN2 (0.43) | SMN1; SMN2CYP4F2CYP4A11PTPN1POLB | |
| SCHEMBL8083686 | 0.88 | CYP4F2 (0.41) | SMN1; SMN2CYP4F2CYP4A11POLBKDM4E | |
| SCHEMBL8076410 | 0.82 | SMN1; SMN2 (0.50) | SMN1; SMN2CYP4F2CYP4A11PTPN1POLB | |
| SCHEMBL8084293 | 0.78 | CYP4F2 (0.38) | SMN1; SMN2CYP4F2CYP4A11KDM4EMEN1 | |
| SCHEMBL417807 | 0.77 | TP53 (0.38) | KDM4EALDH1A1 | |
| SCHEMBL8076400 | 0.76 | CYP4F2 (0.41) | SMN1; SMN2CYP4F2CYP4A11KDM4EALDH1A1 | |
| Toluene SCHEMBL8513838 | 0.73 | SMN1; SMN2 (0.54) | SMN1; SMN2CYP4F2CYP4A11POLBKDM4E | |
| Succinic Acid Diethyl Ester SCHEMBL28851670 | 0.73 | SMN1; SMN2 (0.58) | SMN1; SMN2CYP4F2CYP4A11POLBALDH1A1 | |
| Succinic Acid Diethyl Ester SCHEMBL27940678 | 0.72 | SMN1; SMN2 (0.62) | SMN1; SMN2CYP4F2CYP4A11PTPN1POLB | |
| Phenol SCHEMBL27841259 | 0.71 | SMN1; SMN2 (0.53) | SMN1; SMN2CYP4F2CYP4A11POLBKDM4E |
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-0673942-B1 | Silacyclohexanone compounds as intermediates for the preparation of silacyclohexane-type liquid cristal compounds | SHINETSU CHEMICAL CO (JP) | 2000-11-08 | — | — | EP | disclosed |
| EP-0673942-A1 | Silacyclohexanone compounds as intermediates for the preparation of silacyclohexane-type liquid cristal compounds | Shin-Etsu Chemical Co., Ltd. (JP) | 1995-09-27 | — | — | EP | disclosed |