⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16398785 | 0.94 | — | — | |
| SCHEMBL29919065 | 0.94 | — | — | |
| SCHEMBL19563642 | 0.92 | — | — | |
| SCHEMBL16398548 | 0.89 | — | — | |
| SCHEMBL16408266 | 0.88 | — | — | |
| SCHEMBL16408267 | 0.87 | — | — | |
| SCHEMBL16408241 | 0.87 | — | — | |
| SCHEMBL17791123 | 0.86 | — | — | |
| SCHEMBL29209919 | 0.86 | — | — | |
| SCHEMBL30777733 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3022175-B1 | SULFONAMIDES AS MODULATORS OF SODIUM CHANNELS | VERTEX PHARMA (US) | 2017-11-08 | — | — | EP | disclosed |