SCHEMBL13840914

SCHEMBL13840914

O=C(OCCSc1ccc2c(O)cccc2c1)C(F)(F)SOOO

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 7/20 0.35
HSD17B2 P37059 7/20 0.35
PLAU P00749 1/20 0.33
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
GRIN2D O15399 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31

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
SCHEMBL13840909 0.85 CNR2 (0.40)
SCHEMBL2603120 0.84 PPARG (0.35) HSD17B1HSD17B2PLAU
SCHEMBL13154587 0.82 HSD17B1 (0.36) HSD17B1HSD17B2PLAUESR1ESR2
SCHEMBL13840913 0.82
SCHEMBL13842646 0.80 HSD17B1 (0.36) HSD17B1HSD17B2PLAUESR1ESR2
SCHEMBL13840906 0.79 CNR2 (0.38)
SCHEMBL13840910 0.79 HDAC3 (0.35)
SCHEMBL2603118 0.75 IDO1 (0.39) ESR1ESR2
SCHEMBL14009418 0.75 PPARG (0.36) HSD17B1HSD17B2PLAU
SCHEMBL13840930 0.74 CA1 (0.35) HSD17B1HSD17B2PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7527910-B2 Salt suitable for an acid generator and a chemically amplified resist composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-05 US disclosed
US-20070184382-A1 Salt suitable for an acid generator and a chemically amplified resist composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-08-09 US disclosed