⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14721886 | 0.86 | — | — | |
| SCHEMBL4424759 | 0.83 | ALDH1A1 (0.36) | — | |
| SCHEMBL28844875 | 0.82 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL6666750 | 0.79 | CYP3A4 (0.41) | — | |
| SCHEMBL28844795 | 0.79 | CYP3A4 (0.44) | — | |
| SCHEMBL3789315 | 0.79 | ALOX15 (0.41) | — | |
| SCHEMBL18037696 | 0.75 | TDP1 (0.41) | — | |
| SCHEMBL3156196 | 0.75 | TDP1 (0.41) | — | |
| SCHEMBL1243946 | 0.75 | ALDH1A1 (0.52) | — | |
| SCHEMBL28844852 | 0.75 | ALDH1A1 (0.46) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0712842-B1 | Bisaminothiophenol compound, process for producing the same and curing agent for fluorine-containing elastomer comprising the same | NIPPON MEKTRON KK (JP) | 1998-12-30 | — | — | EP | claimed |
| CN-1474844-A | Polybenzole compound having sulfo group and/or phosphono group, resin composition containing same, molded resin, solid polymer electrotyte film, solid electrolyte film/electrode catalyst layer ... | �����֯��ʽ���� | 2004-02-11 | — | — | CN | disclosed |