⚠ 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 | |
|---|---|---|---|---|
| Vinyl Chloride SCHEMBL27744772 | 0.63 | — | — | |
| SCHEMBL6369223 | 0.56 | — | — | |
| SCHEMBL363537 | 0.56 | — | — | |
| SCHEMBL6850309 | 0.56 | — | — | |
| SCHEMBL6314 | 0.54 | — | — | |
| SCHEMBL2474752 | 0.54 | — | — | |
| Ethylene SCHEMBL9807200 | 0.53 | — | — | |
| SCHEMBL11552183 | 0.50 | — | — | |
| SCHEMBL9751165 | 0.50 | — | — | |
| Sulfurous Acid SCHEMBL21951436 | 0.50 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105722835-B | 3- aryl -5- substitution-isoquinoline-1-ketone compound and their therapy application | 癌症研究协会:皇家癌症医院 | 2018-07-31 | — | — | CN | disclosed |
| CN-105722835-A | 3-aryl-5-substituted-isoquinolin-1-one compounds and their therapeutic use | 癌症研究协会:皇家癌症医院 | 2016-06-29 | — | — | CN | disclosed |
| US-6693090-B2 | OSTEOPOROSIS | AVENTIS PHARMA S.A. (FR) | 2004-02-17 | — | — | US | disclosed |
| US-20030073675-A1 | Novel 19-norsteroids substituted in position 11beta, preparation process and intermediates, application as medicines and pharmaceutical compositions containing them | AVENTIS PHARMA S.A. | 2003-04-17 | — | — | US | disclosed |
| US-6479476-B1 | TREATING MENOPAUSAL SYMPTOMS AND OSTEOPOROSIS IN FEMALE WARM-BLOODED ANIMALS | AVENTIS PHARMA S.A. (FR) | 2002-11-12 | — | — | US | disclosed |
| US-4735747-A | CONTROLLING TEMPERATURE BY INJECTION OF LIQUID SULFUR DIOXIDE | SOCIETE NATIONALE ELF AQUITAINE (PRODUCTION) (FR) | 1988-04-05 | — | — | US | disclosed |