⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9618300 | 0.79 | CES2 (0.32) | — | |
| SCHEMBL11630550 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL27305106 | 0.78 | — | — | |
| SCHEMBL1895685 | 0.77 | — | — | |
| SCHEMBL1583583 | 0.77 | — | — | |
| SCHEMBL1144196 | 0.75 | — | — | |
| SCHEMBL1681615 | 0.75 | CYP4F2 (0.44) | — | |
| SCHEMBL27382350 | 0.74 | MEN1 (0.30) | — | |
| SCHEMBL11475136 | 0.74 | CYP4F2 (0.38) | — | |
| SCHEMBL2325636 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104755473-B | 2,3 benzodiazepine * | 拜耳医药股份有限公司 | 2017-03-08 | — | — | CN | disclosed |
| CN-104755473-A | 2,3-benzodiazepines | Bayer Pharma AG | 2015-07-01 | — | — | CN | disclosed |
| US-8153808-B2 | Dihydropyridone amides as P2X7 modulators | ROCHE PALO ALTO LLC (US) | 2012-04-10 | — | — | US | disclosed |
| EP-2382192-A2 | DIHYDROPYRIDONE AMIDES USEFUL AS MEDICAMENTS FOR THE TREATMENT OF AUTOIMMUNE AND INFLAMMATORY DISEASES | F. Hoffmann-La Roche AG (CH) | 2011-11-02 | — | — | EP | disclosed |
| WO-2010072647-A2 | DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-07-01 | — | — | WO | disclosed |
| US-20100160387-A1 | DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS | ROCHE PALO ALTO LLC | 2010-06-24 | — | — | US | disclosed |
| EP-0245230-A1 | Substituted 2,6-substituted pyridine compounds | Monsanto Company (US) | 1987-11-11 | — | — | EP | disclosed |