SCHEMBL777097

SCHEMBL777097

O=S(=O)(O)c1ccccc1-c1cc(F)cc(F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.40
MYC P01106 1/20 0.40
SLC9A1 P19634 1/20 0.38
ALOX5AP P20292 4/20 0.38
FEN1 P39748 4/20 0.38
HSD11B1 P28845 1/20 0.38
PTGES2 Q9H7Z7 1/20 0.38
P2RY4 P51582 1/20 0.37
PTGS2 P35354 2/20 0.36
PTGS1 P23219 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
PTPN1 P18031 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
KAT6A Q92794 1/20 0.35
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TTR P02766 1/20 0.34

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
SCHEMBL778996 0.86 PTPN1 (0.46) PGAM1SLC9A1ALOX5APFEN1PTGES2
SCHEMBL778751 0.83 PTGS2 (0.53) MYCALOX5APFEN1HSD11B1PTGS2
SCHEMBL28307107 0.81 PTGS2 (0.47) SLC9A1ALOX5APFEN1HSD11B1PTGS2
SCHEMBL778696 0.80 PGAM1 (0.46) PGAM1MYCP2RY4PTPN1TTR
SCHEMBL232659 0.78 CASP1 (0.47) PGAM1MYCPTGS2TSHRSMN1; SMN2
SCHEMBL29743050 0.78 CASP1 (0.47) PGAM1MYCPTGS2TSHRSMN1; SMN2
SCHEMBL27627996 0.78 MYC (0.43) PGAM1MYCCNR1CNR2SMN1; SMN2
SCHEMBL778648 0.77 MAOA (0.35) MYCSLC9A1PTGS2PTGS1SMN1; SMN2
SCHEMBL4996716 0.77 MEN1 (0.48) HSD11B1CNR1CNR2PTPN1
SCHEMBL458284 0.77 SMN1; SMN2 (0.48) PGAM1MYCTSHRSMN1; SMN2TTR

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