SCHEMBL8640255

SCHEMBL8640255

NC(=O)C=Cc1cccc(C(=O)O)c1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.54
TRPA1 O75762 2/20 0.42
TRPM8 Q7Z2W7 2/20 0.42
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
G6PD P11413 1/20 0.38
CASP7 P55210 1/20 0.38
CASP6 P55212 1/20 0.38
MMP2 P08253 1/20 0.38
BCHE P06276 1/20 0.38
GUSB P08236 1/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
NFKB1 P19838 1/20 0.37
CA4 P22748 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
LPAR3 Q9UBY5 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL4619018 0.80 ALDH1A1 (0.48) TRPA1TRPM8ALDH1A1ALOX15CA1
SCHEMBL7925836 0.80 MAPT (0.53) ALDH1A1BCHEGUSBNFKB1MAPT
SCHEMBL7616189 0.80 MAPT (0.53) ALDH1A1BCHEGUSBNFKB1MAPT
SCHEMBL114584 0.77 PTPN1 (0.49) PTPN1TRPA1ALDH1A1ALOX15BCHE
Hydrochloric Acid SCHEMBL9622267 0.76 PTPN1 (0.47) PTPN1TRPA1ALDH1A1ALOX15BCHE
Hydrochloric Acid SCHEMBL894924 0.76 PTPN1 (0.47) PTPN1TRPA1ALDH1A1ALOX15BCHE
SCHEMBL11227663 0.76 ALDH1A1 (0.39) TRPA1TRPM8ALDH1A1ALOX15G6PD
SCHEMBL1646544 0.76 ALDH1A1 (0.46) ALDH1A1ALOX15G6PDCASP7CASP6
SCHEMBL30355310 0.76 ALDH1A1 (0.46) ALDH1A1ALOX15G6PDCASP7CASP6
SCHEMBL2328371 0.75 NFKB1 (0.50) PTPN1CCNCCDK8BCHEGUSB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434145-B1 Acrylamide copolymers containing (meth)acrylamide benzene dicarboxylic units ENIRICERCHE SPA (IT) 1998-08-12 EP disclosed
US-5103057-A ACRYLAMIDE COPOLYMERS CONTAINING (METH)ACRYLAMIDE BENZENE DICARBOXYLIC UNITS ENIRICERCHE S.P.A. (IT) 1992-04-07 US disclosed
EP-0434145-A2 Acrylamide copolymers containing (meth)acrylamide benzene dicarboxylic units ENIRICERCHE S.p.A. (IT) 1991-06-26 EP disclosed