Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | LSS | P48449 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8533991 | 1.00 | HRH3 (0.58) | HRH3CYP3A4CYP2C9KCNH2ACHE | |
| SCHEMBL8532857 | 0.98 | HRH3 (0.56) | HRH3CYP3A4CYP2C9KCNH2ACHE | |
| SCHEMBL8532860 | 0.98 | HRH3 (0.56) | HRH3CYP3A4CYP2C9KCNH2ACHE | |
| SCHEMBL13577677 | 0.92 | HRH3 (0.69) | HRH3HRH4MEN1KMT2AALDH1A1 | |
| SCHEMBL7319627 | 0.86 | HRH3 (0.67) | HRH3KCNH2HRH4MEN1KMT2A | |
| SCHEMBL30596544 | 0.86 | HRH3 (0.67) | HRH3KCNH2HRH4MEN1KMT2A | |
| SCHEMBL3440556 | 0.86 | HRH3 (0.67) | HRH3KCNH2HRH4MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7329891 | 0.85 | HRH3 (0.64) | HRH3KCNH2HRH4MEN1KMT2A | |
| SCHEMBL8534716 | 0.84 | HRH3 (0.57) | HRH3MEN1KMT2AKDM4EESR2 | |
| SCHEMBL8534713 | 0.84 | HRH3 (0.57) | HRH3MEN1KMT2AKDM4EESR2 |
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-0757669-B1 | O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM | BOEHRINGER INGELHEIM PHARMA (DE) | 1998-11-18 | — | — | EP | disclosed |
| EP-0757669-A1 | O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1997-02-12 | — | — | EP | disclosed |
| WO-1995029148-A1 | O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1995-11-02 | — | — | WO | disclosed |