⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13619142 | 0.89 | — | — | |
| SCHEMBL13619153 | 0.87 | CD40 (0.32) | — | |
| SCHEMBL13619137 | 0.83 | ENPP2 (0.30) | — | |
| SCHEMBL13924217 | 0.82 | THRB (0.43) | — | |
| SCHEMBL13619135 | 0.82 | CD40 (0.33) | — | |
| SCHEMBL13433122 | 0.81 | CD40 (0.31) | — | |
| SCHEMBL13619086 | 0.81 | ENPP2 (0.31) | — | |
| SCHEMBL13387166 | 0.79 | THRB (0.33) | — | |
| SCHEMBL13619113 | 0.79 | THRB (0.41) | — | |
| SCHEMBL13420818 | 0.78 | THRB (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7619074-B2 | Reactive dyestuff with N,N-dialkylamino bridge group | EVERLIGHT USA, INC. (US) | 2009-11-17 | — | — | US | disclosed |
| US-20090176972-A1 | Novel reactive dyestuff with N,N-dialkylamino bridge group | EVERLIGHT USA, INC. (US) | 2009-07-09 | — | — | US | disclosed |