SCHEMBL3190469

SCHEMBL3190469

COc1ccc(OCC(=O)OC(C)(C)C)c([S+](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PTPN1 P18031 2/20 0.39
ACLY P53396 1/20 0.39
LMNA P02545 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TP53 P04637 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 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
SCHEMBL9947574 0.93 MAPT (0.47) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3192431 0.91 POLB (0.45) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3204820 0.91 MAPT (0.43) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3181577 0.91 PTPN1 (0.43) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3190064 0.86 MAPT (0.43) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3192462 0.86 MAPT (0.42) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3193941 0.86 PTGDR2 (0.43) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL30440133 0.84 POLB (0.43) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3199978 0.84 MAPT (0.45) POLBMAPTCYP2C9HPGDCYP2C19
SCHEMBL3181640 0.83 MAPT (0.49) POLBMAPTCYP2C9HPGDCYP2C19

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