SCHEMBL778996

SCHEMBL778996

O=S(=O)(O)c1ccccc1-c1cccc(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.46
MAOB P27338 1/20 0.44
P2RY4 P51582 1/20 0.44
ALOX5AP P20292 4/20 0.42
FEN1 P39748 4/20 0.42
ESR2 Q92731 1/20 0.42
PGAM1 P18669 1/20 0.41
SLC9A1 P19634 1/20 0.41
SLC22A12 Q96S37 1/20 0.40
PDK2 Q15119 1/20 0.40
HTT P42858 1/20 0.40
F10 P00742 1/20 0.40
KAT6A Q92794 1/20 0.40
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
NFKB1 P19838 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL777097 0.86 PGAM1 (0.40) PTPN1P2RY4ALOX5APFEN1PGAM1
SCHEMBL3836209 0.83 ALOX5AP (0.48) MAOBALOX5APFEN1SLC9A1SLC22A12
SCHEMBL2566974 0.83 ALOX5AP (0.56) MAOBALOX5APFEN1F10PTGES2
SCHEMBL776571 0.81 MAPT (0.44) PTPN1ESR2SLC9A1SLC22A12LMNA
SCHEMBL10459345 0.81 CHRM1 (0.51) MAOBSLC9A1PDK2F10KAT6A
SCHEMBL778751 0.80 PTGS2 (0.53) MAOBALOX5APFEN1MAPTSMN1; SMN2
SCHEMBL8997316 0.80 KAT6A (0.47) ALOX5APFEN1HTTF10KAT6A
SCHEMBL3884580 0.79 CNR2 (0.44) MAOBSLC9A1PDK2MAPTNFKB1
SCHEMBL31213502 0.79 ALDH1A1 (0.50) ALOX5APFEN1LMNATP53MAPT
SCHEMBL232659 0.79 CASP1 (0.47) PGAM1SMN1; SMN2

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