⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL883182 | 0.75 | F2 (0.50) | — | |
| SCHEMBL3420777 | 0.73 | — | — | |
| SCHEMBL27958958 | 0.73 | — | — | |
| SCHEMBL11074994 | 0.73 | F2 (0.37) | — | |
| SCHEMBL14699330 | 0.73 | — | — | |
| SCHEMBL31460021 | 0.70 | HTT (0.33) | — | |
| SCHEMBL9410508 | 0.70 | F2 (0.35) | — | |
| SCHEMBL22637999 | 0.69 | HCAR3 (0.43) | — | |
| SCHEMBL22637693 | 0.69 | KMT2A (0.46) | — | |
| SCHEMBL856957 | 0.68 | POLB (0.52) | — |
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-20240252473-A1 | Sulfoximines as inhibitors of NaV1.8 | GRUENENTHAL GMBH (DE) | 2024-08-01 | — | — | US | disclosed |