⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5597108 | 0.81 | CYP3A4 (0.34) | — | |
| SCHEMBL21117 | 0.79 | MEN1 (0.30) | — | |
| SCHEMBL2459722 | 0.78 | — | — | |
| SCHEMBL11168973 | 0.70 | GABRA1 (0.46) | — | |
| SCHEMBL1079642 | 0.70 | ACHE (0.39) | — | |
| SCHEMBL11328243 | 0.67 | — | — | |
| SCHEMBL29483754 | 0.66 | ALDH1A1 (0.34) | — | |
| SCHEMBL145276 | 0.66 | ALDH1A1 (0.34) | — | |
| SCHEMBL17501723 | 0.66 | XPO1 (0.37) | — | |
| SCHEMBL811195 | 0.66 | PTGS2 (0.36) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7504094-B2 | Cosmetic compositions containing a particular aminosilicone and a thickener, and uses thereof | L'OREAL, S.A. (FR) | 2009-03-17 | — | — | US | claimed |
| US-20070154434-A1 | Cosmetic compositions containing a particular aminosilicone and a thickener, and uses thereof | L'OREAL S.A. | 2007-07-05 | — | — | US | claimed |
| US-20030152542-A1 | Cosmetic compositions containing a particular aminosilicone and a thickener, and uses thereof | L'OREAL S.A. (FR) | 2003-08-14 | — | — | US | claimed |
| US-20030147827-A1 | Cosmetic compositions containing a particular aminosilicone and a thickener, and uses thereof | L'OREAL S.A. (FR) | 2003-08-07 | — | — | US | claimed |
| US-20150044156-A1 | HAIR PREPARATIONS COMPRISING HYDROXY-TERMINATED ORGANOPOLYSILOXANE(S) AND THICKENER(S) | HENKEL AG & CO. KGAA (DE) | 2015-02-12 | — | — | US | disclosed |