⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8658140 | 0.69 | — | — | |
| SCHEMBL7034297 | 0.69 | — | — | |
| SCHEMBL29549338 | 0.69 | — | — | |
| SCHEMBL28882353 | 0.68 | — | — | |
| SCHEMBL9736077 | 0.68 | TDP1 (0.34) | — | |
| SCHEMBL7753486 | 0.66 | — | — | |
| SCHEMBL1576319 | 0.66 | — | — | |
| SCHEMBL9260367 | 0.66 | — | — | |
| SCHEMBL8511120 | 0.66 | — | — | |
| SCHEMBL28565567 | 0.66 | — | — |
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-5349057-A | Water soluble azo dyes containing a cyanoamino-triazinyl-amino group and a fiber-reactive of the sulfone series | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-09-20 | — | — | US | disclosed |