SCHEMBL2139882

SCHEMBL2139882

C=CCN(CC=C)CC(O)CCl

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 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
Hydrochloric Acid SCHEMBL1627565 0.98 ALDH1A1 (0.42) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL3836004 0.85 ALDH1A1 (0.49) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2484810 0.79 ALDH1A1 (0.45) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL9718366 0.79 CYP3A4 (0.45) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL27493816 0.78 ALDH1A1 (0.32) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL15827375 0.77 ALDH1A1 (0.44) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL5230532 0.77 CA1 (0.45) ALDH1A1TSHRCA1CA2CA9
Hydrochloric Acid SCHEMBL21802477 0.77 ALDH1A1 (0.31) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL4155298 0.76 ALDH1A1 (0.42) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL10611848 0.75 ALDH1A1 (0.41) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285742-A Diallyl ammonium salt composition and preparation method thereof 江苏海洋大学 2023-12-26 CN claimed
EP-3056549-B1 COLORANT COMPOSITION AND USES THEREOF AHLSTROEM OY (FI) 2022-11-16 EP claimed
EP-3626331-B1 SEPARATION MEMBRANE NITTO DENKO CORP (JP) 2022-04-06 EP claimed
EP-0960233-A1 DYEING OF TEXTILES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1999-12-01 EP claimed
WO-1998037270-A1 DYEING OF TEXTILES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1998-08-27 WO claimed
JP-7316061-A None JP disclosed
CN-117285742-A Diallyl ammonium salt composition and preparation method thereof 江苏海洋大学 2023-12-26 CN disclosed
EP-3685199-B1 METHODS OF MANUFACTURING COATED CONTACT LENSES COOPERVISION INT LTD (GB) 2021-08-04 EP disclosed
US-11067831-B2 Methods of manufacturing coated contact lenses COOPERVISION INTERNATIONAL LIMITED (GB) 2021-07-20 US disclosed
EP-3685199-A1 METHODS OF MANUFACTURING COATED CONTACT LENSES CooperVision International Holding Company, LP (BB) 2020-07-29 EP disclosed
US-20190129202-A1 Methods of Manufacturing Coated Contact Lenses COOPERVISION INTERNATIONAL HOLDING COMPANY, LP (BB) 2019-05-02 US disclosed
US-20170306101-A1 THIOUREA-CONTAINING DENDRIMER AND THIOUREA-CONTAINING HYPERBRANCHED POLYMER AS WELL AS PREPARATION METHODS THEREOF AND APPLICATIONS THEREOF ZHEJIANG UNIVERSITY (CN) 2017-10-26 US disclosed
US-5147411-A Pretreating or concurrent treatment of fibers CIBA-GEIGY CORPORATION (US) 1992-09-15 US disclosed
EP-0213317-B1 BASE-CATALYZED, LOW TEMPERATURE SELF-CROSSLINKING POLYMERS National Starch and Chemical Investment Holding Corporation (US) 1991-12-04 EP disclosed
EP-0447352-A1 Process for improving the yield and the wet fastness of the dyeing or printing with anionic dyes of cellulosic fibrous material CIBA-GEIGY AG (CH) 1991-09-18 EP disclosed
US-4788267-A CONTAINING HALOHYDRIN MONOMER AND AMINE SALT MONOMER NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1988-11-29 US disclosed
US-4689418-A MONOMERS FOR DIALLYLAMINE POLYMERS PETROLITE CORPORATION (US) 1987-08-25 US disclosed
US-4383926-A N,N-DIALLYL-3-HYDROXYAZETIDINIUM HALIDES PETROLITE CORPORATION (US) 1983-05-17 US disclosed
US-4341887-A N,N-DIALLYL-3-HYDROXY-AZETIDINIUM HALIDE; DEMULSIFIERS, WATER TREATMENT PETROLITE CORPORATION (US) 1982-07-27 US disclosed
US-4229433-A HOMO- OR COPOLYMER OF A DIALLYLAMINE SALT OR A DIALLYL QUATERNARY AMMONIUM DERIVATIVE MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1980-10-21 US disclosed