SCHEMBL290064

SCHEMBL290064

C=C(C)C(=O)NC(CC)[N+](C)(C)CCCCCCCCCCCC

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
TGFBR1 P36897 1/20 0.36
SLC22A1 O15245 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PLA2G2A P14555 1/20 0.34
PLA2G5 P39877 1/20 0.34
DNM1 Q05193 3/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL15579564 1.00 TSHR (0.36) TSHRTGFBR1SLC22A1ALDH1A1TP53
Hydrochloric Acid SCHEMBL10384670 0.98 TSHR (0.38) TSHRTGFBR1SLC22A1ALDH1A1TP53
Hydrochloric Acid SCHEMBL1977629 0.98 TSHR (0.38) TSHRTGFBR1SLC22A1ALDH1A1TP53
Hydrochloric Acid SCHEMBL331220 0.98 TSHR (0.38) TSHRTGFBR1SLC22A1ALDH1A1TP53
Hydrochloric Acid SCHEMBL10383896 0.98 TSHR (0.38) TSHRTGFBR1SLC22A1ALDH1A1TP53
Hydrochloric Acid SCHEMBL10425311 0.85 TGFBR1 (0.39) TGFBR1
Hydrochloric Acid SCHEMBL10384579 0.82 TSHR (0.41) TSHRTGFBR1PLA2G2APLA2G5
Hydrochloric Acid SCHEMBL10383887 0.82 TSHR (0.41) TSHRTGFBR1PLA2G2APLA2G5
SCHEMBL16224241 0.81 TGFBR1 (0.36) TGFBR1
SCHEMBL9451823 0.80 TGFBR1 (0.42) TGFBR1ALDH1A1

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 78 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1357884-B2 COMPOSITION FOR TREATING KERATINOUS MATERIALS COMPRISING A CATIONIC POLY(ALKYL) VINYLLACTAM POLYMER AND A CONDITIONING AGENT OREAL (FR) 2019-11-13 EP claimed
EP-1800660-B2 Cosmetic ingredient comprising at least one cationic poly(vinyllactam), at least one specific cross-linked cationic polymer and at least one non-volatile silicon OREAL (FR) 2019-03-27 EP claimed
EP-1809234-B1 CLEAR, TOW-PHASE, FOAM-FORMING AEROSOL HAIRSTYLING PRODUCT Wella GmbH (DE) 2012-02-01 EP claimed
EP-1357884-B1 COMPOSITION FOR TREATING KERATINOUS MATERIALS COMPRISING A CATIONIC POLY(ALKYL) VINYLLACTAM POLYMER AND A CONDITIONING AGENT OREAL (FR) 2010-04-28 EP claimed
EP-1588692-B1 Durable foamed composition WELLA AG (DE) 2008-09-24 EP claimed
EP-1584323-B1 Use of N-hydroxyalkyl-O-benzylchitosans in hair treatment WELLA AG (DE) 2007-10-24 EP claimed
EP-1357884-A1 COMPOSITION FOR TREATING KERATINOUS MATERIALS COMPRISING A CATIONIC POLY(ALKYL) VINYLLACTAM POLYMER AND A PROTECTING OR CONDITIONING AGENT L'OREAL (FR) 2003-11-05 EP claimed
WO-2002058646-A1 COMPOSITION FOR TREATING KERATINOUS MATERIALS COMPRISING A CATIONIC POLY(ALKYL) VINYLLACTAM POLYMER AND A PROTECTING OR CONDITIONING AGENT L'OREAL (FR) 2002-08-01 WO claimed
EP-2649137-B2 N-ACYL AMINO ACID AS CORROSION PROTECTION HENKEL AG & CO KGAA (DE) 2020-11-25 EP disclosed
EP-1357884-B2 COMPOSITION FOR TREATING KERATINOUS MATERIALS COMPRISING A CATIONIC POLY(ALKYL) VINYLLACTAM POLYMER AND A CONDITIONING AGENT OREAL (FR) 2019-11-13 EP disclosed
EP-2816995-B1 HAIR TREATMENT METHOD KAO GERMANY GMBH (DE) 2019-04-10 EP disclosed
EP-2649137-B1 N-ACYL AMINO ACID AS CORROSION PROTECTION HENKEL AG & CO KGAA (DE) 2018-01-03 EP disclosed
EP-1800659-B1 Cosmetic composition comprising at least one cationic polyvinyllactam, at least one fatty alcohol and at least one polyol, method for treatment of keratin fibres and use L'ORÉAL (FR) 2017-09-27 EP disclosed
EP-2934471-B1 METHOD FOR THE GENTLE HEAT-ASSISTED SHAPING OF KERATIN FIBERS CRODA INT PLC (GB) 2017-09-13 EP disclosed
WO-2010020505-A2 AGENT FOR FIBRES CONTAINING KERATIN, COMPRISING AT LEAST ONE SPECIFIC AMPHIPHILIC CATIONIC POLYMER, AT LEAST ONE CATIONIC STYLING POLYMER THAT IS DIFFERENT THEREFROM AND AT LEAST ONE FILM-FORMING NON-IONIC AND/OR STABILIZING NON-IONIC POLYMER HENKEL AG & CO. KGAA (DE) 2010-02-25 WO disclosed
WO-2010000608-A1 COMPOSITION FOR KERATINOUS FIBRES, COMPRISING AT LEAST ONE SPECIFIC BETAINE COMPOUND AND AT LEAST ONE FILM-FORMING AND/OR SETTING POLYMER HENKEL AG & CO. KGAA (DE) 2010-01-07 WO disclosed
WO-2010000607-A2 COMPOSITION FOR KERATIN-CONTAINING FIBRES CONTAINING AT LEAST ONE SPECIAL CELLULOSE AND AT LEAST ONE ADDITIONAL FILM-FORMING POLYMER AND/OR STRENGTHENING POLYMER HENKEL AG & CO. KGAA (DE) 2010-01-07 WO disclosed
EP-1600150-A1 Composition for the treatment of keratinous materials containing a specific polycarboxylic compound and a thickening polymer, and processes using this composition L'OREAL (FR) 2005-11-30 EP disclosed
EP-1357884-A1 COMPOSITION FOR TREATING KERATINOUS MATERIALS COMPRISING A CATIONIC POLY(ALKYL) VINYLLACTAM POLYMER AND A PROTECTING OR CONDITIONING AGENT L'OREAL (FR) 2003-11-05 EP disclosed
WO-2002058646-A1 COMPOSITION FOR TREATING KERATINOUS MATERIALS COMPRISING A CATIONIC POLY(ALKYL) VINYLLACTAM POLYMER AND A PROTECTING OR CONDITIONING AGENT L'OREAL (FR) 2002-08-01 WO disclosed