SCHEMBL6419402

SCHEMBL6419402

C=CC(=O)NC(C)(CC)S(=O)(=O)O.[Na]

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 3/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TGM2 P21980 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
SCHEMBL234712 0.98 ALDH1A1 (0.39) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
Ammonia Solution, Strong SCHEMBL28169209 0.96 ALDH1A1 (0.38) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
Acrylic Acid SCHEMBL1123835 0.93 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
Acrylic Acid SCHEMBL27348963 0.90 ALDH1A1 (0.35) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
Methacrylic Acid SCHEMBL8466985 0.89 ALDH1A1 (0.37) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
SCHEMBL27674635 0.88 TDP1 (0.35) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
Acrylic Acid SCHEMBL27647713 0.85 ALDH1A1 (0.32) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
SCHEMBL29192529 0.84 ZDHHC20 (0.40) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20
Diethylaminoethanol SCHEMBL11691979 0.84 ALDH1A1 (0.32) ALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL25284730 0.83 ALDH1A1 (0.36) ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6894110-B2 Preparation of water soluble polymer dispersions from vinylamide monomers NALCO COMPANY (US) 2005-05-17 US claimed
EP-0970258-B1 POLYMERIC COMBINATIONS USED AS COPPER AND PRECIOUS METAL HEAP LEACHING AGGLOMERATION AIDS NALCO CHEMICAL CO (US) 2003-05-07 EP claimed
EP-0984990-B1 PREPARATION OF WATER SOLUBLE POLYMER DISPERSIONS FROM VINYLAMIDE MONOMERS NALCO CHEMICAL CO (US) 2003-03-19 EP claimed
US-20020198317-A1 Preparation of water soulble polymer dispersions from vinylamide monomers ECOLAB USA INC. 2002-12-26 US claimed
US-6426383-B1 POLYMERIZING NONIONIC POLYVINYLACETAMIDE DISPERSED IN AQUEOUS SOLUTION CONTAINING POLYVINYL ALCOHOL AS STABILIZER NALCO CHEMICAL COMPANY 2002-07-30 US claimed
US-6225430-B1 FOR INHIBITING PRECIPITATION AND DEPOSITION OF SCALE ON METAL SURFACES IN CONTACT WITH INDUSTRIAL COOLING WATERS NALCO CHEMICAL COMPANY 2001-05-01 US claimed
EP-0984990-A1 PREPARATION OF WATER SOLUBLE POLYMER DISPERSIONS FROM VINYLAMIDE MONOMERS NALCO CHEMICAL COMPANY (US) 2000-03-15 EP claimed
EP-0970258-A1 POLYMERIC COMBINATIONS USED AS COPPER AND PRECIOUS METAL HEAP LEACHING AGGLOMERATION AIDS NALCO CHEMICAL COMPANY (US) 2000-01-12 EP claimed
WO-1999020803-A1 POLYMERIC COMBINATIONS USED AS COPPER AND PRECIOUS METAL HEAP LEACHING AGGLOMERATION AIDS NALCO CHEMICAL COMPANY (US) 1999-04-29 WO claimed
WO-1998054234-A1 PREPARATION OF WATER SOLUBLE POLYMER DISPERSIONS FROM VINYLAMIDE MONOMERS NALCO CHEMICAL COMPANY (US) 1998-12-03 WO claimed
US-5833937-A AGGLOMERATING BY SEQUENTIAL ADDITION OF FIRST WATER SOLUBLE ANIONIC OR NONIONIC POLYMER AND SECOND CATIONIC WATER SOLUBLE POLYMER NALCO CHEMICAL COMPANY (US) 1998-11-10 US claimed
EP-0832854-A1 Sulfobetaine-containing polymers and their utility as calcium carbonate scale inhibitors NALCO CHEMICAL COMPANY (US) 1998-04-01 EP claimed
US-5092935-A Acrylamide-Vinylformamide Interpolymer BASF CORPORATION (US) 1992-03-03 US claimed
EP-0444489-A1 Cementing compositions containing a copolymer as a fluid loss control additive BASF CORPORATION (US) 1991-09-04 EP claimed
EP-0342500-A2 Fluid loss control additives for oil well cementing compositions BASF Corporation (US) 1989-11-23 EP claimed
CN-109478401-A Fiber for sound absorbing/insulating material, use of the fiber, method for producing fiber for sound absorbing/insulating material, and molded fiber for sound absorbing/insulating material 三菱化学株式会社 2019-03-15 CN disclosed
CN-106164112-B The adhesive of paper coating compositions 瓦克化学公司 2018-02-06 CN disclosed
US-4704324-A REVERSE OSMOSIS, GAS SEPARATION, ULTRAFILTRATION THE DOW CHEMICAL COMPANY (US) 1987-11-03 US disclosed
WO-1987002682-A1 SEMI-PERMEABLE MEMBRANES PREPARED VIA REACTION OF CATIONIC GROUPS WITH NUCLEOPHILIC GROUPS THE DOW CHEMICAL COMPANY (US) 1987-05-07 WO disclosed
EP-0220660-A2 Semi-permeables membranes prepared via reaction of cationic groups with nucleophilic groups THE DOW CHEMICAL COMPANY (US) 1987-05-06 EP disclosed