SCHEMBL778058

SCHEMBL778058

Cc1ccc(S(=O)(=O)O)cc1C1CCC(F)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA12 O43570 2/20 0.36
CA7 P43166 2/20 0.36
CA14 Q9ULX7 2/20 0.36
ALDH1A1 P00352 4/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
PTGS2 P35354 1/20 0.35
SNCA P37840 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
HSD11B1 P28845 1/20 0.34
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL29104732 0.92 CA1 (0.41) CA1CA2CA12CA7CA14
SCHEMBL8763566 0.86 ALDH1A1 (0.43) CA1CA2CA12CA7CA14
SCHEMBL656155 0.84 PTGS2 (0.42) CA1CA2CA12CA7CA14
SCHEMBL778787 0.83 ALDH1A1 (0.35) CA1CA2CA12CA7CA14
SCHEMBL8788235 0.82 CYP2D6 (0.37) CA1CA2CA12CA7CA14
SCHEMBL9099580 0.82 ALDH1A1 (0.38) CA1CA2CA12CA7CA14
SCHEMBL8089603 0.81 MEN1 (0.38) CA1CA2CA12CA7CA14
SCHEMBL1714160 0.79 TSHR (0.35) CA1CA2CA12CA7CA14
SCHEMBL2486113 0.79 TSHR (0.35) CA1CA2CA12CA7CA14
SCHEMBL1714508 0.79 TSHR (0.35) CA1CA2CA12CA7CA14

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