⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14159110 | 0.96 | THRB (0.31) | — | |
| SCHEMBL14159127 | 0.83 | POLB (0.31) | — | |
| SCHEMBL14159101 | 0.83 | SIRT5 (0.31) | — | |
| SCHEMBL14159128 | 0.79 | THRB (0.37) | — | |
| SCHEMBL14159100 | 0.76 | THRB (0.37) | — | |
| SCHEMBL14159125 | 0.74 | PHLPP2 (0.31) | — | |
| SCHEMBL14159120 | 0.74 | PHLPP2 (0.38) | — | |
| SCHEMBL14159111 | 0.73 | THRB (0.40) | — | |
| SCHEMBL14159115 | 0.72 | PHLPP2 (0.41) | — | |
| SCHEMBL14159098 | 0.72 | THRB (0.36) | — |
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-7390889-B1 | Trisazo reactive dyestuff compound | EVERLIGHT USA, INC. (US) | 2008-06-24 | — | — | US | disclosed |