SCHEMBL3206458

SCHEMBL3206458

COc1ccc([S+](c2ccccc2)c2ccccc2)c(O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.49
ALDH1A1 P00352 5/20 0.49
LMNA P02545 4/20 0.49
CYP1A2 P05177 3/20 0.49
PGR P06401 2/20 0.49
SLC6A2 P23975 2/20 0.49
CYP2C19 P33261 2/20 0.49
MAPK1 P28482 2/20 0.49
CYP2D6 P10635 1/20 0.49
PDE4A P27815 1/20 0.49
HRH1 P35367 1/20 0.49
HTT P42858 1/20 0.49
SLC6A3 Q01959 1/20 0.49
PDE4D Q08499 1/20 0.49
CYP3A4 P08684 3/20 0.46
ADORA3 P0DMS8 1/20 0.46
AR P10275 1/20 0.46
CHRM1 P11229 1/20 0.46
ALOX15 P16050 1/20 0.46
TBXA2R P21731 1/20 0.46

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
SCHEMBL3197728 0.88 MEN1 (0.44) HPGDALDH1A1LMNACYP1A2PGR
SCHEMBL3203674 0.82 CA12 (0.48) ALDH1A1LMNACYP1A2CYP2C19CYP2D6
SCHEMBL3201024 0.82 GAA (0.47) ALDH1A1LMNACYP1A2HTTNPC1
SCHEMBL3197623 0.81 KIF11 (0.40) HPGDALDH1A1LMNACYP1A2PGR
SCHEMBL3193140 0.79 ALOX5 (0.48) HPGDALDH1A1CYP1A2MAPK1CYP3A4
SCHEMBL3193543 0.79 GAA (0.44) HPGDALDH1A1LMNACYP1A2PGR
SCHEMBL3203135 0.79 CA12 (0.48) ALDH1A1LMNACYP1A2MAPK1NPC1
SCHEMBL3192396 0.77 MAOB (0.48) ALDH1A1CYP3A4MAPTMEN1KMT2A
SCHEMBL3201005 0.76 CYP1A2 (0.38) ALDH1A1LMNACYP1A2CYP2C19CYP2D6
SCHEMBL12172612 0.76 NQO1 (0.43) HPGDALDH1A1LMNACYP1A2CYP3A4

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