⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4410998 | 0.80 | — | — | |
| SCHEMBL387416 | 0.76 | — | — | |
| SCHEMBL387519 | 0.74 | OPRM1 (0.39) | — | |
| SCHEMBL5755851 | 0.74 | CYP2C19 (0.38) | — | |
| SCHEMBL6422454 | 0.74 | ALDH1A1 (0.39) | — | |
| SCHEMBL387436 | 0.73 | — | — | |
| SCHEMBL875233 | 0.72 | — | — | |
| SCHEMBL5843500 | 0.72 | — | — | |
| SCHEMBL1454247 | 0.72 | — | — | |
| SCHEMBL1970041 | 0.71 | — | — |
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-1515684-A2 | CARE AND/OR MAKE-UP COSMETIC COMPOSITION STRUCTURED WITH SILICONE POLYMERS AND ORGANOGELLING AGENTS, IN RIGID FORM | L'OREAL (FR) | 2005-03-23 | — | — | EP | claimed |
| WO-2003105788-A2 | CARE AND/OR MAKE-UP COSMETIC COMPOSITION STRUCTURED WITH SILICONE POLYMERS AND ORGANOGELLING AGENTS, IN RIGID FORM | L'OREAL (FR) | 2003-12-24 | — | — | WO | claimed |