⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6167542 | 0.71 | — | — | |
| SCHEMBL6169527 | 0.55 | — | — | |
| SCHEMBL8523749 | 0.55 | — | — | |
| SCHEMBL15798921 | 0.50 | — | — | |
| SCHEMBL11330344 | 0.46 | — | — | |
| SCHEMBL22977587 | 0.44 | — | — | |
| SCHEMBL30854779 | 0.44 | — | — | |
| Maleic Anhydride SCHEMBL21900332 | 0.41 | HSP90AA1 (0.33) | — | |
| SCHEMBL2697928 | 0.40 | — | — | |
| SCHEMBL8624409 | 0.40 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5116981-A | Antiinflammatory leukotriene B4 analogs | THE UPJOHN COMPANY (US) | 1992-05-26 | — | — | US | disclosed |
| EP-0339046-A1 | LEUKOTRIENE B 4? ANALOGS. | UPJOHN CO (US) | 1989-11-02 | — | — | EP | disclosed |
| WO-1988005045-A1 | LEUKOTRIENE B4 ANALOGS | THE UPJOHN COMPANY (US) | 1988-07-14 | — | — | WO | disclosed |