⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3344718 | 0.78 | THRB (0.40) | — | |
| SCHEMBL12955806 | 0.76 | — | — | |
| SCHEMBL8665797 | 0.76 | LMNA (0.43) | — | |
| SCHEMBL859766 | 0.76 | — | — | |
| SCHEMBL142064 | 0.76 | — | — | |
| SCHEMBL3141884 | 0.76 | — | — | |
| SCHEMBL12955873 | 0.76 | — | — | |
| SCHEMBL15137737 | 0.76 | — | — | |
| SCHEMBL4446268 | 0.76 | — | — | |
| SCHEMBL23454258 | 0.74 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4046757-A | 2-Optionally substituted alkyl-and phenylsulfonylphenyl-azo-phenyl dyes and a process for their synthesis | SANDOZ LTD. (CH) | 1977-09-06 | — | — | US | claimed |
| US-5580870-A | ANTICARCINOGENIC AGENTS | ZENECA LIMITED (GB) | 1996-12-03 | — | — | US | disclosed |
| US-4386935-A | Process for producing discharge reserve prints on textile materials with amino-azo-benzene dyes | CASSELLA AKTIENGESELLSCHAFT (DE) | 1983-06-07 | — | — | US | disclosed |