⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8713775 | 0.63 | — | — | |
| SCHEMBL11001674 | 0.61 | ALDH1A1 (0.31) | — | |
| SCHEMBL10887101 | 0.61 | — | — | |
| SCHEMBL2120931 | 0.59 | — | — | |
| SCHEMBL14653331 | 0.57 | ALDH1A1 (0.31) | — | |
| SCHEMBL10867581 | 0.55 | — | — | |
| SCHEMBL15713526 | 0.51 | IDO1 (0.34) | — | |
| SCHEMBL3518192 | 0.46 | ALDH1A1 (0.38) | — | |
| SCHEMBL338007 | 0.43 | MEN1 (0.75) | — | |
| SCHEMBL8577936 | 0.43 | — | — |
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-20090123711-A1 | Disperse azo dyes and mixtures comprising these disperse azo dyes | CLARIANT FINANCE (BVI) LIMITED (VG) | 2009-05-14 | — | — | US | disclosed |