SCHEMBL3206235

SCHEMBL3206235

CCCCCCCCCCOc1ccc([S+](c2ccccc2)c2ccccc2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.49
PTPN11 Q06124 1/20 0.46
TSHR P16473 2/20 0.46
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
PLA2G4B P0C869 3/20 0.43
NR5A1 Q13285 1/20 0.43
TP53 P04637 1/20 0.42
DRD2 P14416 2/20 0.42
DRD3 P35462 2/20 0.42
DRD4 P21917 1/20 0.42
PDK2 Q15119 1/20 0.41
PTPN1 P18031 1/20 0.41
MLNR O43193 1/20 0.40
NR1I2 O75469 1/20 0.40
ESR1 P03372 1/20 0.40
NR3C1 P04150 1/20 0.40
PGR P06401 1/20 0.40
ADRB2 P07550 1/20 0.40
CHRM2 P08172 1/20 0.40

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
SCHEMBL3182715 1.00 LTA4H (0.49) LTA4HPTPN11TSHRTHRATHRB
SCHEMBL3201064 1.00 LTA4H (0.49) LTA4HPTPN11TSHRTHRATHRB
SCHEMBL3206783 0.96 LTA4H (0.47) LTA4HPTPN11TSHRTHRATHRB
SCHEMBL3192234 0.90 DRD2 (0.41) LTA4HDRD2DRD3DRD4PDK2
SCHEMBL2437395 0.81 LTA4H (0.64) LTA4HTSHRPLA2G4BNR5A1TP53
SCHEMBL482139 0.81 LTA4H (0.64) LTA4HTSHRPLA2G4BNR5A1TP53
SCHEMBL9333524 0.81 LTA4H (0.64) LTA4HTSHRPLA2G4BNR5A1TP53
SCHEMBL482305 0.81 LTA4H (0.64) LTA4HTSHRPLA2G4BNR5A1TP53
SCHEMBL482308 0.81 LTA4H (0.64) LTA4HTSHRPLA2G4BNR5A1TP53
Ethane SCHEMBL2441158 0.79 LTA4H (0.62) LTA4HTSHRPLA2G4BNR5A1TP53

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