Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP46A1 | Q9Y6A2 | 12/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22719256 | 1.00 | CYP46A1 (0.53) | CYP46A1ALDH1A1HCRTR1HCRTR2 | |
| SCHEMBL22719285 | 0.94 | CYP46A1 (0.50) | CYP46A1ALDH1A1 | |
| SCHEMBL22719464 | 0.93 | CYP46A1 (0.52) | CYP46A1ALDH1A1 | |
| SCHEMBL22719463 | 0.92 | CYP46A1 (0.48) | CYP46A1ALDH1A1 | |
| SCHEMBL22719283 | 0.91 | CYP46A1 (0.65) | CYP46A1ALDH1A1 | |
| SCHEMBL29453733 | 0.91 | CYP46A1 (0.47) | CYP46A1ALDH1A1 | |
| SCHEMBL22719294 | 0.91 | CYP46A1 (0.47) | CYP46A1ALDH1A1 | |
| SCHEMBL14849071 | 0.87 | CYP46A1 (0.69) | CYP46A1 | |
| SCHEMBL14841897 | 0.85 | CYP46A1 (0.62) | CYP46A1ALDH1A1 | |
| SCHEMBL22719357 | 0.85 | CYP46A1 (0.64) | CYP46A1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3976186-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | Sage Therapeutics, Inc. (US) | 2022-04-06 | — | — | EP | disclosed |