⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1464307 | 0.84 | — | — | |
| SCHEMBL1463435 | 0.83 | DNM1 (0.46) | — | |
| SCHEMBL599737 | 0.80 | — | — | |
| SCHEMBL19987907 | 0.78 | — | — | |
| SCHEMBL22689603 | 0.74 | CYP1A2 (0.30) | — | |
| SCHEMBL9239033 | 0.74 | — | — | |
| SCHEMBL6257280 | 0.73 | — | — | |
| SCHEMBL1464177 | 0.72 | MAOA (0.40) | — | |
| SCHEMBL240359 | 0.70 | ODC1 (0.33) | — | |
| SCHEMBL4343030 | 0.70 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2039345-A1 | Cosmetic compositions containing a cationic copolymer and a particular triglyceride and uses thereof | L'Oréal (FR) | 2009-03-25 | — | — | EP | disclosed |