⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19287916 | 0.83 | ALDH1A1 (0.40) | — | |
| SCHEMBL4437848 | 0.81 | ALDH1A1 (0.43) | — | |
| SCHEMBL5117455 | 0.79 | MEN1 (0.30) | — | |
| SCHEMBL5107545 | 0.79 | ALOX5 (0.36) | — | |
| SCHEMBL5110203 | 0.79 | — | — | |
| SCHEMBL5117460 | 0.79 | ALDH1A1 (0.37) | — | |
| SCHEMBL4019745 | 0.78 | PHF8 (0.39) | — | |
| SCHEMBL18936236 | 0.77 | TSHR (0.42) | — | |
| SCHEMBL4816761 | 0.76 | LMNA (0.31) | — | |
| SCHEMBL5107237 | 0.75 | ALDH1A1 (0.37) | — |
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-7365067-B2 | Indanol derivative | SANKYO COMPANY, LIMITED (JP) | 2008-04-29 | — | — | US | disclosed |
| US-20070197570-A1 | Indanol derivative | SANKYO COMPANY, LIMITED (JP) | 2007-08-23 | — | — | US | disclosed |
| EP-1746095-A1 | INDANOL DERIVATIVE | Sankyo Company, Limited (JP) | 2007-01-24 | — | — | EP | disclosed |