⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3269854 | 0.79 | MAOA (0.46) | — | |
| SCHEMBL3267572 | 0.75 | — | — | |
| SCHEMBL23793080 | 0.66 | HSD17B1 (0.33) | — | |
| SCHEMBL31674281 | 0.66 | HSD17B1 (0.33) | — | |
| SCHEMBL3273769 | 0.66 | PARP1 (0.44) | — | |
| SCHEMBL3272388 | 0.66 | CYP11B2 (0.42) | — | |
| SCHEMBL6158541 | 0.64 | MAOA (0.36) | — | |
| SCHEMBL3269583 | 0.62 | NOTUM (0.30) | — | |
| SCHEMBL3268676 | 0.62 | ERN1 (0.34) | — | |
| SCHEMBL4501201 | 0.61 | ERN1 (0.39) | — |
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-1914229-B1 | NOVEL CERCOSPORAMIDE DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2010-06-16 | — | — | EP | disclosed |
| US-20090036492-A1 | Novel Cercosporamide Derivative | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2009-02-05 | — | — | US | disclosed |
| EP-1914229-A1 | NOVEL CERCOSPORAMIDE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2008-04-23 | — | — | EP | disclosed |