⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20207744 | 0.97 | SIGMAR1 (0.79) | — | |
| SCHEMBL22519336 | 0.97 | SIGMAR1 (0.79) | — | |
| SCHEMBL21574012 | 0.97 | SIGMAR1 (0.79) | — | |
| SCHEMBL920031 | 0.92 | — | — | |
| SCHEMBL6969290 | 0.90 | SIGMAR1 (0.91) | — | |
| SCHEMBL6975263 | 0.88 | SIGMAR1 (0.96) | — | |
| SCHEMBL22697176 | 0.88 | SIGMAR1 (0.88) | — | |
| SCHEMBL19631563 | 0.88 | SIGMAR1 (0.88) | — | |
| SCHEMBL26431397 | 0.88 | SIGMAR1 (0.96) | — | |
| Hydrochloric Acid SCHEMBL9718246 | 0.86 | SIGMAR1 (0.92) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0870765-B1 | AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS | ZERIA PHARM CO LTD (JP) | 2003-11-19 | — | — | EP | disclosed |
| US-5981557-A | HAVING IMPROVING EFFECTS ON THE DYSMOTILITY IN THE GASTROINTESTINAL TRACT | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 1999-11-09 | — | — | US | disclosed |
| EP-0870765-A1 | AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 1998-10-14 | — | — | EP | disclosed |