SCHEMBL410006

SCHEMBL410006

C=CCC=C(C)C(=O)OCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.45
CYP2C19 P33261 2/20 0.45
GLO1 Q04760 1/20 0.44
NPSR1 Q6W5P4 4/20 0.39
ALDH1A1 P00352 6/20 0.39
LMNA P02545 4/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
S1PR4 O95977 1/20 0.39
S1PR1 P21453 1/20 0.39
MAPK1 P28482 1/20 0.39
TSHR P16473 1/20 0.38
TRPA1 O75762 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL10764193 0.85 TSHR (0.38) CYP2D6CYP2C19ALDH1A1LMNAHSD17B10
SCHEMBL666513 0.84 CYP3A4 (0.40) CYP2D6CYP2C19NPSR1ALDH1A1HSD17B10
SCHEMBL5983748 0.84 CYP3A4 (0.40) CYP2D6CYP2C19NPSR1ALDH1A1HSD17B10
SCHEMBL28797840 0.84 CYP2D6 (0.33) CYP2D6CYP2C19
SCHEMBL6991044 0.82 CYP2D6 (0.32) CYP2D6CYP2C19
Ammonia Solution, Strong SCHEMBL7152100 0.82 CYP3A4 (0.39) CYP2D6CYP2C19NPSR1ALDH1A1HSD17B10
SCHEMBL6991052 0.82 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL8971295 0.82 TSHR (0.50) CYP2D6CYP2C19ALDH1A1LMNAMAPK1
SCHEMBL2475285 0.81 CYP2C19 (0.33) CYP2D6CYP2C19GLO1ALDH1A1LMNA
SCHEMBL16618080 0.81 ALDH1A1 (0.32) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7208556-B2 Water-soluble or water-swellable crosslinked copolymers CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2007-04-24 US claimed
US-20050165188-A1 Water-soluble or water-swellable crosslinked copolymers CLARIANT GMBH 2005-07-28 US claimed
US-6891009-B2 Water-soluble or water-swellable crosslinked copolymers CLARIANT GMBH (DE) 2005-05-10 US claimed
US-6683144-B2 SALTS OF ACRYLAMIDOALKYLSULFONIC ACIDS AND CYCLIC OR LINEAR N-VINYLCARBOXAMIDES MONOMERS WITH CROSSLINKERS HAVING MULTIPLE DOUBLE BONDS; THICKENERS, EMULSION AND DISPERSION STABILLIZERS AND AS GLIDANTS IN COSMETIC AND PHARMACEUTICALS CLARIANT GMBH (DE) 2004-01-27 US claimed
US-6437068-B2 THICKENER FOR COSMETIC, DRUGS CLARIANT GMBH (DE) 2002-08-20 US claimed
US-4396680-A Substrate coated with crater resistant acrylic enamel E. I. DU PONT DE NEMOURS AND CO. (US) 1983-08-02 US claimed
US-4371657-A AMINO RESIN CROSSLINKING E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-02-01 US claimed
JP-63236515-A None JP disclosed
CN-109312098-A Composition for foam molded article and method for producing same, and modified cellulose-containing resin composition for foam molded article 星光PMC株式会社 2019-02-05 CN disclosed
CN-103555119-A Coating for polyolefin membrane as well as modified polyolefin membrane and coating preparation method of coating CHINA HAISUM ENG CO LTD 2014-02-05 CN disclosed
EP-1664222-B1 METHOD FOR ACHIEVING RECOAT ADHESION OVER A FLUORINATED TOPCOAT DU PONT (US) 2012-01-25 EP disclosed
EP-2015858-B1 NONWOVEN WEB OF POLYMER-COATED NANOFIBERS DU PONT (US) 2011-09-14 EP disclosed
US-20100136865-A1 Nonwoven web of polymer-coated nanofibers E. I. DU PONT DE NEMOURS AND COMPANY 2010-06-03 US disclosed
US-5629372-A CURED WITH POLYISOCYANATE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1997-05-13 US disclosed
WO-1997014733-A1 COATING COMPOSITIONS OF AN ACRYLIC FLUOROCARBON POLYMER AND A FLUORINATED POLYISOCYANATE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-04-24 WO disclosed
WO-1997014732-A1 ACRYLIC FLUOROCARBON POLYMER CONTAINING COATINGS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-04-24 WO disclosed
US-5597874-A POLYISOCYANATE CROSSLINKING AGENT FOR COPOLYMERS OF HYDROXY (METH)ACRYLATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1997-01-28 US disclosed
JP-S63236515-A GAS SEPARATING MEMBRANE MITSUBISHI PAPER MILLS LTD 1988-10-03 JP disclosed
US-4396680-A Substrate coated with crater resistant acrylic enamel E. I. DU PONT DE NEMOURS AND CO. (US) 1983-08-02 US disclosed
US-4371657-A AMINO RESIN CROSSLINKING E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-02-01 US disclosed