⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31288439 | 0.87 | ESR1 (0.31) | — | |
| SCHEMBL8968837 | 0.83 | — | — | |
| SCHEMBL6703907 | 0.83 | ESR1 (0.34) | — | |
| SCHEMBL11094520 | 0.82 | — | — | |
| SCHEMBL419488 | 0.80 | ESR1 (0.38) | — | |
| SCHEMBL14649161 | 0.78 | ESR1 (0.37) | — | |
| SCHEMBL29032531 | 0.78 | ESR1 (0.37) | — | |
| SCHEMBL890423 | 0.75 | ESR1 (0.34) | — | |
| SCHEMBL30003124 | 0.75 | ESR1 (0.34) | — | |
| SCHEMBL13621383 | 0.74 | ESR1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100210498-A1 | MAKEUP REMOVER GEL CONTAINING JOJOBA OIL | L'OREAL (FR) | 2010-08-19 | — | — | US | disclosed |
| US-20070207937-A1 | GELLED COMPOSITION | L'OREAL (FR) | 2007-09-06 | — | — | US | disclosed |