⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28848079 | 0.75 | — | — | |
| SCHEMBL27933925 | 0.72 | — | — | |
| SCHEMBL16241279 | 0.69 | — | — | |
| SCHEMBL29632536 | 0.69 | — | — | |
| SCHEMBL21852708 | 0.69 | — | — | |
| SCHEMBL5272252 | 0.69 | — | — | |
| SCHEMBL17448553 | 0.69 | — | — | |
| SCHEMBL21979533 | 0.69 | — | — | |
| SCHEMBL9223462 | 0.68 | — | — | |
| SCHEMBL31343470 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112368274-A | Pyridine-sulfonamide derivatives as sodium channel inhibitors | 豪夫迈·罗氏有限公司 | 2021-02-12 | — | — | CN | disclosed |