SCHEMBL776846

SCHEMBL776846

Cc1ccc(S(=O)(=O)O)cc1-c1cccc(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.39
PTGS2 P35354 10/20 0.39
PTGS1 P23219 5/20 0.38
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SNCA P37840 1/20 0.37
CASP6 P55212 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
SCN9A Q15858 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL780162 0.88 KMT2A (0.40) PTGS2PTGS1TSHRSNCASMN1; SMN2
SCHEMBL11324926 0.82 ALDH1A1 (0.45) ALDH1A1TDP1TSHRHSD17B10SNCA
SCHEMBL3885125 0.80 CA12 (0.47) ALDH1A1TDP1TSHRHSD17B10SNCA
SCHEMBL6882888 0.79 CA12 (0.52) ALDH1A1TDP1TSHRHSD17B10SNCA
SCHEMBL779326 0.78 PTGS2 (0.39) PTGS2PTGS1ALDH1A1TDP1TSHR
SCHEMBL20867918 0.77 ALDH1A1 (0.39) ALDH1A1TDP1TSHRHSD17B10SNCA
SCHEMBL780396 0.77 PARP1 (0.40) PTGS2PTGS1SCN9A
SCHEMBL16115127 0.76 ALDH1A1 (0.38) ALDH1A1TDP1TSHRHSD17B10SNCA
SCHEMBL776573 0.76 PTPN1 (0.42) SLC9A1PTGS2PTGS1
SCHEMBL10305000 0.75 PDE2A (0.41) HSD17B10SMN1; SMN2KDM4EMAPTL3MBTL1

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