⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL22243016 | 0.92 | ALDH1A1 (0.30) | — | |
| SCHEMBL339935 | 0.92 | — | — | |
| SCHEMBL1089804 | 0.92 | ALDH1A1 (0.30) | — | |
| SCHEMBL8065057 | 0.92 | — | — | |
| SCHEMBL1088944 | 0.92 | — | — | |
| SCHEMBL25134064 | 0.92 | ALDH1A1 (0.30) | — | |
| SCHEMBL339936 | 0.92 | — | — | |
| SCHEMBL1089803 | 0.92 | ALDH1A1 (0.30) | — | |
| SCHEMBL13562 | 0.91 | — | — | |
| SCHEMBL770757 | 0.88 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6617299-B1 | Contacting the textile with a ligand which forms a complex with a transition metal, whereby the complex catalyses bleaching of the textile by atmospheric oxygen without use of aldehydes, wherein at | UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. | 2003-09-09 | — | — | US | disclosed |