⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8416121 | 0.78 | SLC6A4 (0.38) | — | |
| SCHEMBL1961286 | 0.75 | — | — | |
| SCHEMBL1269475 | 0.74 | — | — | |
| SCHEMBL9446602 | 0.74 | SLC6A4 (0.36) | — | |
| SCHEMBL22184478 | 0.72 | — | — | |
| SCHEMBL1300948 | 0.72 | — | — | |
| SCHEMBL1960602 | 0.70 | ADH1B (0.33) | — | |
| SCHEMBL7161881 | 0.70 | SLC6A4 (0.32) | — | |
| SCHEMBL7161883 | 0.70 | SLC6A4 (0.32) | — | |
| SCHEMBL1165257 | 0.69 | — | — |
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-2337554-B1 | AGENT FOR FIBRES CONTAINING KERATIN, COMPRISING AT LEAST ONE SPECIFIC AMPHIPHILIC CATIONIC POLYMER AND AT LEAST ONE SPECIFIC, ADDITIONAL FILM-FORMING ANIONIC AND/OR STABILIZING ANIONIC POLYMER | HENKEL AG & CO KGAA (DE) | 2016-09-07 | — | — | EP | claimed |
| US-20110142781-A1 | AGENT FOR FIBERS CONTAINING KERATIN, COMPRISING AT LEAST ONE SPECIFIC AMPHIPHILIC CATIONIC POLYMER AND AT LEAST ONE SPECIFIC, ADDITIONAL FILM-FORMING ANIONIC AND/OR STABILIZING ANIONIC POLYMER | HENKEL AG & CO. KGAA (DE) | 2011-06-16 | — | — | US | claimed |
| US-20180200177-A1 | STRAIGHTENING AGENT CONTAINING A POLYMER COMBINATION OF POLYURETHANES AND AMODIMETHICONES | HENKEL AG & CO. KGAA (DE) | 2018-07-19 | — | — | US | disclosed |
| US-8685377-B2 | Agent for fibers containing keratin, comprising at least one specific amphiphilic cationic polymer and at least one specific, additional film-forming anionic and/or stabilizing anionic polymer | HENKEL AG & CO. KGAA (DE) | 2014-04-01 | — | — | US | disclosed |
| US-20110142781-A1 | AGENT FOR FIBERS CONTAINING KERATIN, COMPRISING AT LEAST ONE SPECIFIC AMPHIPHILIC CATIONIC POLYMER AND AT LEAST ONE SPECIFIC, ADDITIONAL FILM-FORMING ANIONIC AND/OR STABILIZING ANIONIC POLYMER | HENKEL AG & CO. KGAA (DE) | 2011-06-16 | — | — | US | disclosed |
| US-20110142781-A1 | AGENT FOR FIBERS CONTAINING KERATIN, COMPRISING AT LEAST ONE SPECIFIC AMPHIPHILIC CATIONIC POLYMER AND AT LEAST ONE SPECIFIC, ADDITIONAL FILM-FORMING ANIONIC AND/OR STABILIZING ANIONIC POLYMER | HENKEL AG & CO. KGAA (DE) | 2011-06-16 | — | — | US | disclosed |