⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3045323 | 0.73 | — | — | |
| SCHEMBL423635 | 0.71 | — | — | |
| SCHEMBL13938121 | 0.71 | — | — | |
| SCHEMBL1235472 | 0.62 | — | — | |
| SCHEMBL13005211 | 0.58 | — | — | |
| SCHEMBL3040316 | 0.58 | — | — | |
| SCHEMBL18813440 | 0.56 | — | — | |
| SCHEMBL12192292 | 0.56 | — | — | |
| SCHEMBL12993014 | 0.56 | — | — | |
| SCHEMBL354646 | 0.56 | — | — |
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-20100215604-A1 | Cosmetic Compositions with Chitosan and Silicone Elastomers | HENKEL AG & CO. KGAA (DE) | 2010-08-26 | — | — | US | disclosed |
| US-6471730-B1 | READY TO USE HAIR DYE CONTAINING OXIDATION COLORING AGENT, CATIONIC POLYMERS AND ENZYME; HYDROGEN PEROXIDE FREE; HOMOGENEOUS, INTENSE; NONDEGRADING OR DECOLOURING OF KERATINOUS FIBERS | L'OREAL (FR) | 2002-10-29 | — | — | US | disclosed |