Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL4350030 | 0.86 | ALDH1A1 (0.31) | ALDH1A1LMNA | |
| SCHEMBL5788029 | 0.80 | CYP3A4 (0.45) | ALDH1A1 | |
| SCHEMBL22602515 | 0.76 | ALDH1A1 (0.30) | ALDH1A1LMNA | |
| SCHEMBL4350033 | 0.76 | GABRA1 (0.33) | — | |
| SCHEMBL15589318 | 0.75 | ALDH1A1 (0.38) | ALDH1A1LMNA | |
| SCHEMBL1399737 | 0.72 | ABCB11 (0.34) | ALDH1A1 | |
| SCHEMBL13788635 | 0.69 | ALDH1A1 (0.34) | ALDH1A1LMNA | |
| SCHEMBL17650560 | 0.69 | ALDH1A1 (0.37) | ALDH1A1LMNA | |
| SCHEMBL30940600 | 0.68 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL3229637 | 0.68 | ALDH1A1 (0.36) | ALDH1A1 |
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-1311475-B1 | AMINOCYCLOHEXANE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-08-06 | — | — | EP | disclosed |