SCHEMBL778163

SCHEMBL778163

O=S(=O)(O)c1ccccc1-c1cccc(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 1/20 0.41
SLC9A1 P19634 2/20 0.39
GRK6 P43250 1/20 0.38
CES2 O00748 1/20 0.38
BCHE P06276 1/20 0.38
CES1 P23141 1/20 0.38
TTR P02766 2/20 0.38
FABP4 P15090 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
MAPK14 Q16539 1/20 0.38
NR4A1 P22736 1/20 0.37
PGAM1 P18669 1/20 0.37
AKR1B1 P15121 1/20 0.36
ALOX5AP P20292 2/20 0.36
FEN1 P39748 2/20 0.36
DHODH Q02127 1/20 0.36
MYC P01106 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL776011 0.86 NPSR1 (0.43) SLC9A1CES2CES1TTRPGAM1
SCHEMBL229902 0.82 PTGES2 (0.46) PTGES2CES2BCHECES1TTR
SCHEMBL458284 0.82 SMN1; SMN2 (0.48) CES2BCHECES1TTRFABP4
SCHEMBL776844 0.80 SLC9A1 (0.39) SLC9A1DHODHMAPTNPSR1KAT6A
Hydrochloric Acid SCHEMBL27565435 0.80 PTGES2 (0.45) PTGES2CES2BCHECES1TTR
SCHEMBL28837581 0.80 SMN1; SMN2 (0.46) CES2BCHECES1TTRFABP4
SCHEMBL30476135 0.78 KAT6A (0.46) CES2CES1TTRAKR1B1MYC
SCHEMBL231071 0.78 KAT6A (0.46) CES2CES1TTRAKR1B1MYC
SCHEMBL776521 0.77 PGAM1 (0.46) CES2BCHECES1TTRPGAM1
SCHEMBL8379379 0.76 KAT6A (0.44) CES2CES1TTRAKR1B1MYC

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-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed