Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14718584 | 1.00 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL6945178 | 0.81 | CA2 (0.35) | — | |
| SCHEMBL1878666 | 0.79 | CA1 (0.33) | — | |
| SCHEMBL728723 | 0.78 | — | — | |
| SCHEMBL28062571 | 0.76 | CA2 (0.35) | — | |
| SCHEMBL29002441 | 0.76 | ALDH1A1 (0.50) | — | |
| SCHEMBL10822298 | 0.75 | TP53 (0.47) | — | |
| SCHEMBL14840204 | 0.75 | TP53 (0.47) | — | |
| SCHEMBL26929110 | 0.75 | TP53 (0.47) | — | |
| Hydrochloric Acid SCHEMBL15439947 | 0.75 | ALDH1A1 (0.37) | — |
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-0659877-B1 | Composition for the treatment of textiles | CIBA SC HOLDING AG (CH) | 2003-06-04 | — | — | EP | claimed |