SCHEMBL776933

SCHEMBL776933

CC(c1ccc(F)cc1F)S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.45
CES1 P23141 3/20 0.45
PSEN1 P49768 6/20 0.44
PSEN2 P49810 6/20 0.44
APH1B Q8WW43 6/20 0.44
NCSTN Q92542 6/20 0.44
APH1A Q96BI3 6/20 0.44
PSENEN Q9NZ42 6/20 0.44
RECQL P46063 1/20 0.38
PKM P14618 1/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
HSD11B1 P28845 1/20 0.35
PDE2A O00408 1/20 0.35
APLNR P35414 2/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL26312524 0.79 PSEN1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL776465 0.77 CES2 (0.42) CES2CES1
SCHEMBL778768 0.75 CES2 (0.33) CES2CES1PSEN1PSEN2APH1B
SCHEMBL18242589 0.74 CES2 (0.47) CES2CES1PSEN1PSEN2APH1B
SCHEMBL1998132 0.74 CES2 (0.52) CES2CES1RECQLIDO1TDO2
SCHEMBL17947416 0.74 CES2 (0.52) CES2CES1RECQLIDO1TDO2
SCHEMBL29453648 0.74 CES2 (0.52) CES2CES1RECQLIDO1TDO2
SCHEMBL15853708 0.74 CES2 (0.52) CES2CES1RECQLIDO1TDO2
SCHEMBL84105 0.73 CES2 (0.46) CES2CES1PSEN1PSEN2APH1B
SCHEMBL24938981 0.72 PDE2A (0.61) CES2CES1PSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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