Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7696013 | 0.75 | — | — | |
| SCHEMBL3777302 | 0.69 | — | — | |
| SCHEMBL5639429 | 0.69 | — | — | |
| SCHEMBL6175747 | 0.69 | — | — | |
| SCHEMBL5639143 | 0.67 | TDP1 (0.33) | ALDH1A1 | |
| SCHEMBL4719866 | 0.67 | — | — | |
| SCHEMBL6748489 | 0.63 | — | — | |
| SCHEMBL6308653 | 0.63 | — | — | |
| SCHEMBL6315723 | 0.63 | TP53 (0.31) | — | |
| SCHEMBL4592421 | 0.63 | CES2 (0.39) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002020487-A1 | SUBSTITUTED 1-ARYL-PYRIDIN-2-(THI)ONES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-03-14 | — | — | WO | disclosed |