⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11658732 | 0.97 | PTPN7 (0.48) | — | |
| SCHEMBL9732267 | 0.97 | PTPN7 (0.48) | — | |
| SCHEMBL8551377 | 0.97 | PTPN7 (0.48) | — | |
| SCHEMBL8030954 | 0.97 | PTPN7 (0.48) | — | |
| SCHEMBL7572259 | 0.97 | — | — | |
| SCHEMBL1557548 | 0.90 | — | — | |
| SCHEMBL10941675 | 0.88 | — | — | |
| SCHEMBL1760799 | 0.83 | PTPN7 (0.56) | — | |
| SCHEMBL23040316 | 0.80 | PTPN7 (0.61) | — | |
| SCHEMBL11066113 | 0.80 | PTPN7 (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 |
|---|---|---|---|---|---|---|---|
| US-4315032-A | ANTITHROMBOGENIC AGENTS, ANTIULCER AGENTS | TEITIN LIMITED (JP) | 1982-02-09 | — | — | US | disclosed |
| EP-0019475-A2 | Process for preparing adjacently disubstituted ketones, novel prostaglandins E1 and anti-thrombotic compositions containing them | TEIJIN LIMITED (JP) | 1980-11-26 | — | — | EP | disclosed |
| US-4175201-A | Chemical synthesis | UNIVERSITY OF CHICAGO (US) | 1979-11-20 | — | — | US | disclosed |
| US-4018820-A | Chemical synthesis | THE UNIVERSITY OF CHICAGO (US) | 1977-04-19 | — | — | US | disclosed |