⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2298640 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL5183654 | 0.72 | — | — | |
| SCHEMBL11327127 | 0.71 | — | — | |
| SCHEMBL28120800 | 0.69 | — | — | |
| SCHEMBL14817574 | 0.69 | — | — | |
| Water SCHEMBL7157150 | 0.67 | — | — | |
| SCHEMBL10928502 | 0.65 | — | — | |
| SCHEMBL7058496 | 0.65 | — | — | |
| SCHEMBL3844855 | 0.64 | — | — | |
| SCHEMBL1013973 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0744955-B1 | CYCLIC HEPTAPEPTIDE ANTI-INFLAMMATORY AGENT | UNIV CALIFORNIA (US) | 2002-07-31 | — | — | EP | disclosed |
| US-5593960-A | PRODUCING CYCLOMARIN A FROM FERMENTATION OF STREPTOMYCES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1997-01-14 | — | — | US | disclosed |
| US-5444043-A | Cyclic depsipeptide non-steroidal antiinflammatory agent | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1995-08-22 | — | — | US | disclosed |