Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 18/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6246501 | 0.89 | CYP19A1 (0.52) | ALDH1A1CYP1A2CYP2D6CYP19A1 | |
| SCHEMBL11851731 | 0.87 | CYP19A1 (0.54) | CYP19A1 | |
| SCHEMBL11843636 | 0.84 | CYP19A1 (0.51) | CYP19A1 | |
| SCHEMBL7749405 | 0.81 | CYP19A1 (0.45) | CYP19A1 | |
| SCHEMBL6139175 | 0.81 | CYP19A1 (0.45) | CYP19A1 | |
| Hydrochloric Acid SCHEMBL7505934 | 0.80 | CYP19A1 (0.44) | CYP19A1 | |
| Glutethimide SCHEMBL113709 | 0.78 | CYP19A1 (0.72) | ALDH1A1CYP1A2CYP2D6CYP19A1 | |
| Glutethimide SCHEMBL21119240 | 0.78 | CYP19A1 (0.72) | ALDH1A1CYP1A2CYP2D6CYP19A1 | |
| Glutethimide SCHEMBL113708 | 0.78 | CYP19A1 (0.72) | ALDH1A1CYP1A2CYP2D6CYP19A1 | |
| Phenglutarimide SCHEMBL250700 | 0.77 | CYP19A1 (0.56) | ALDH1A1CYP1A2CYP2D6CYP19A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3985888-A | Methods of inducing sedation using certain spiroalkanone-imides | RICHARDSON-MERRELL INC. (US) | 1976-10-12 | — | — | US | disclosed |