⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7851825 | 0.89 | ALDH1A1 (0.35) | — | |
| SCHEMBL7852897 | 0.87 | ALDH1A1 (0.33) | — | |
| SCHEMBL7854405 | 0.87 | ALDH1A1 (0.33) | — | |
| SCHEMBL677195 | 0.69 | — | — | |
| SCHEMBL1856016 | 0.63 | — | — | |
| SCHEMBL1775895 | 0.59 | ALDH1A1 (0.47) | — | |
| SCHEMBL23203 | 0.59 | ALDH1A1 (0.47) | — | |
| SCHEMBL7845053 | 0.59 | — | — | |
| SCHEMBL3975125 | 0.59 | — | — | |
| SCHEMBL7853217 | 0.59 | ALDH1A1 (0.47) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0719258-B1 | CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS | OTSUKA PHARMA CO LTD (JP) | 2001-10-31 | — | — | EP | disclosed |
| US-5786367-A | OXYGEN SCAVENGERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-07-28 | — | — | US | disclosed |