⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9839055 | 0.60 | — | — | |
| SCHEMBL28272232 | 0.56 | — | — | |
| SCHEMBL19302087 | 0.53 | — | — | |
| SCHEMBL4280013 | 0.51 | — | — | |
| Zinc Ion SCHEMBL27977876 | 0.46 | MEN1 (0.75) | — | |
| Zinc Ion SCHEMBL27603437 | 0.46 | MEN1 (0.75) | — | |
| Zinc Ion SCHEMBL43192 | 0.46 | — | — | |
| SCHEMBL3677237 | 0.46 | MEN1 (0.75) | — | |
| SCHEMBL733789 | 0.46 | MEN1 (0.75) | — | |
| SCHEMBL51949 | 0.45 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0259738-B1 | HETEROCYCLIC COMPOUNDS | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1991-04-03 | — | — | EP | disclosed |
| EP-0259738-A2 | Heterocyclic compounds | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1988-03-16 | — | — | EP | disclosed |