SCHEMBL3204433

SCHEMBL3204433

Oc1ccc(O)c([S+](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.42
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
GFER P55789 1/20 0.39
CA12 O43570 3/20 0.38
CA2 P00918 3/20 0.38
CA9 Q16790 3/20 0.38
CA14 Q9ULX7 3/20 0.38
NFE2L2 Q16236 2/20 0.38
TYR P14679 2/20 0.38
CA1 P00915 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
HSD17B10 Q99714 2/20 0.38
NR1I2 O75469 1/20 0.38
CYP2C9 P11712 1/20 0.38
MIF P14174 1/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
PTGS2 P35354 1/20 0.38

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
SCHEMBL3193140 0.85 ALOX5 (0.48) ALOX5GAAPOLBGFERCA12
SCHEMBL3203071 0.80 TRPA1 (0.45) GAAPOLBALDH1A1LMNAHSD17B10
SCHEMBL3191983 0.80 ESR2 (0.44) ALOX5GAATYRALDH1A1LMNA
SCHEMBL31005107 0.78 ALDH1A1 (0.43) POLBCA12CA2CA9CA14
SCHEMBL3200953 0.78 ALDH1A1 (0.43) POLBCA12CA2CA9CA14
SCHEMBL3191952 0.76 ESR2 (0.48) ALOX5GAAALDH1A1LMNAHSD17B10
SCHEMBL3197728 0.76 MEN1 (0.44) GAAPOLBTYRALDH1A1LMNA
SCHEMBL3202166 0.76 MAOB (0.44) GAACA12CA2CA9CA14
SCHEMBL3190241 0.73 ALDH1A1 (0.43) POLBCA12CA2CA9CA14
SCHEMBL30249405 0.73 ALDH1A1 (0.43) POLBCA12CA2CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed
US-20100028800-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2010-02-04 US disclosed
EP-1953593-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2008-08-06 EP disclosed
US-7060414-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-06-13 US disclosed
US-20050158657-A1 Radiation-sensitive resin composition SUZUKI AKI (JP) 2005-07-21 US disclosed
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US disclosed
US-20020090569-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-07-11 US disclosed