⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL423372 | 0.84 | — | — | |
| SCHEMBL17576274 | 0.81 | — | — | |
| SCHEMBL15393297 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL6384223 | 0.74 | — | — | |
| SCHEMBL25131085 | 0.71 | — | — | |
| SCHEMBL22558622 | 0.71 | TSHR (0.32) | — | |
| SCHEMBL1515537 | 0.71 | — | — | |
| SCHEMBL20115375 | 0.71 | TSHR (0.39) | — | |
| SCHEMBL365870 | 0.71 | — | — | |
| SCHEMBL27764274 | 0.71 | TSHR (0.32) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4552630-A1 | RESORCINOL FREE PERMANENT HAIR COLOR COMPOSITION AND METHOD | Wella Operations US, LLC (US) | 2025-05-14 | — | — | EP | claimed |
| EP-2621890-B1 | QUATERNARY AMMONIUM POLYHYDROXYL COMPOUNDS AND THEIR USE IN PERSONAL CARE COMPOSITIONS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2015-07-22 | — | — | EP | disclosed |
| EP-2621890-A1 | QUATERNARY AMMONIUM POLYHYDROXYL COMPOUNDS AND THEIR USE IN PERSONAL CARE COMPOSITIONS | Dow Global Technologies LLC (US) | 2013-08-07 | — | — | EP | disclosed |
| US-20130178542-A1 | MONOCATIONIC POLYHYDROXYL COMPOUNDS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2013-07-11 | — | — | US | disclosed |
| WO-2012050769-A1 | QUATERNARY AMMONIUM POLYHYDROXYL COMPOUNDS AND THEIR USE IN PERSONAL CARE COMPOSITIONS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-04-19 | — | — | WO | disclosed |
| EP-1275703-A2 | Water resistant polymer composition for ink formulation | SCOTT BADER COMPANY LIMITED (GB) | 2003-01-15 | — | — | EP | disclosed |