⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6989237 | 1.00 | — | — | |
| SCHEMBL193385 | 0.83 | — | — | |
| SCHEMBL8788700 | 0.82 | — | — | |
| Methyl Alcohol SCHEMBL27575048 | 0.71 | TSHR (0.54) | — | |
| Ethane SCHEMBL18543108 | 0.71 | TSHR (0.54) | — | |
| SCHEMBL9465110 | 0.71 | TSHR (0.33) | — | |
| SCHEMBL9465114 | 0.71 | TSHR (0.33) | — | |
| SCHEMBL28182 | 0.71 | — | — | |
| SCHEMBL1593359 | 0.71 | TSHR (0.64) | — | |
| SCHEMBL102859 | 0.71 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0344543-B1 | CONDENSED DIAZEPINONES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1992-07-22 | — | — | EP | claimed |
| US-5006522-A | Vagal pacemaker for treatment of bradycardia or radyarrhythmia | KARL THOMAE GMBH (DE) | 1991-04-09 | — | — | US | claimed |
| EP-0344543-A2 | Condensed diazepinones, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1989-12-06 | — | — | EP | claimed |
| EP-1150963-B1 | SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | AVENTIS PHARMA GMBH (DE) | 2003-12-03 | — | — | EP | disclosed |
| EP-0344543-B1 | CONDENSED DIAZEPINONES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1992-07-22 | — | — | EP | disclosed |
| US-5006522-A | Vagal pacemaker for treatment of bradycardia or radyarrhythmia | KARL THOMAE GMBH (DE) | 1991-04-09 | — | — | US | disclosed |
| EP-0344543-A2 | Condensed diazepinones, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1989-12-06 | — | — | EP | disclosed |