Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL22096866 | 0.77 | — | — | |
| SCHEMBL22600547 | 0.75 | CYP3A4 (0.34) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL24476958 | 0.75 | POLB (0.39) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL10385464 | 0.73 | CD44 (0.41) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL13363108 | 0.72 | CYP3A4 (0.39) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL24428041 | 0.72 | ALDH1A1 (0.32) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL19636756 | 0.72 | ALDH1A1 (0.37) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL27402558 | 0.72 | ALDH1A1 (0.32) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL24447277 | 0.69 | ALDH1A1 (0.30) | ALDH1A1TDP1CASP1CYP3A4TSHR | |
| SCHEMBL1201240 | 0.69 | CYP3A4 (0.36) | ALDH1A1TDP1CASP1CYP3A4TSHR |
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-4223761-A1 | QUINAZOLINE COMPOUND AND APPLICATION THEREOF | Shanghai Pharmaceuticals Holding Co., Ltd. (CN) | 2023-08-09 | — | — | EP | disclosed |