⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1629367 | 0.67 | — | — | |
| SCHEMBL725380 | 0.63 | — | — | |
| SCHEMBL5908563 | 0.62 | GABRA1 (0.38) | — | |
| SCHEMBL11234560 | 0.62 | — | — | |
| SCHEMBL8921258 | 0.61 | GABRA1 (0.35) | — | |
| SCHEMBL7811004 | 0.61 | — | — | |
| SCHEMBL11254840 | 0.61 | — | — | |
| SCHEMBL9178725 | 0.61 | — | — | |
| SCHEMBL6861221 | 0.61 | — | — | |
| SCHEMBL30460635 | 0.61 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0008361-B1 | HALOGEN-SUBSTITUTED THIOPHENE DERIVATIVES AND METHOD FOR THEIR PREPARATION | BASF Aktiengesellschaft (DE) | 1982-01-27 | — | — | EP | disclosed |
| US-4288449-A | DIURETICS | BASF AKTIENGESELLSCHAFT (DE) | 1981-09-08 | — | — | US | disclosed |
| EP-0008367-A1 | N-Arylsulfonyl pyrroles, their preparation and medicaments containing them | BASF Aktiengesellschaft (DE) | 1980-03-05 | — | — | EP | disclosed |
| EP-0008361-A1 | Halogen-substituted thiophene derivatives and method for their preparation | BASF Aktiengesellschaft (DE) | 1980-03-05 | — | — | EP | disclosed |