Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.58 |
| ▸ | DRD3 | P35462 | 4/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.51 |
| ▸ | DRD4 | P21917 | 2/20 | 0.50 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9204778 | 0.85 | DRD2 (0.54) | DRD2DRD3SIGMAR1DRD4HTR1A | |
| SCHEMBL9874332 | 0.84 | DRD2 (0.61) | DRD2DRD3SIGMAR1DRD4KCNA3 | |
| SCHEMBL4483728 | 0.83 | DRD2 (0.62) | DRD2DRD3SIGMAR1DRD4KCNA3 | |
| SCHEMBL4483845 | 0.82 | DRD2 (0.64) | DRD2DRD3SIGMAR1DRD4KCNA3 | |
| SCHEMBL9773137 | 0.82 | DRD2 (0.64) | DRD2DRD3SIGMAR1DRD4KCNA3 | |
| SCHEMBL4483844 | 0.79 | DRD2 (0.58) | DRD2DRD3SIGMAR1DRD4KCNA3 | |
| SCHEMBL4485693 | 0.78 | DRD2 (0.54) | DRD2DRD3SIGMAR1DRD4KCNA3 | |
| SCHEMBL9203036 | 0.76 | DRD2 (0.67) | DRD2DRD3SIGMAR1HTR1A | |
| SCHEMBL9206102 | 0.76 | DRD2 (0.67) | DRD2DRD3SIGMAR1HTR1A | |
| SCHEMBL9199501 | 0.76 | DRD2 (0.67) | DRD2DRD3SIGMAR1HTR1A |
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-0431580-B1 | Substituted cyclohexanols as central nervous system agents | WARNER LAMBERT CO (US) | 1995-03-08 | — | — | EP | disclosed |
| US-5047406-A | Substituted cyclohexanols as central nervous system agents | WARNER-LAMBERT CO. (US) | 1991-09-10 | — | — | US | disclosed |
| EP-0431580-A2 | Substituted cyclohexanols as central nervous system agents | WARNER-LAMBERT COMPANY (US) | 1991-06-12 | — | — | EP | disclosed |