SCHEMBL777112

SCHEMBL777112

CC(F)c1ccccc1S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.46
HSD11B1 P28845 1/20 0.39
MMP1 P03956 2/20 0.38
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
MMP8 P22894 2/20 0.38
MMP12 P39900 2/20 0.38
MMP13 P45452 2/20 0.38
MMP14 P50281 2/20 0.38
MMP16 P51512 2/20 0.38
HTR2A P28223 2/20 0.38
HTR2C P28335 2/20 0.38
KCNH2 Q12809 2/20 0.38
CYP1A2 P05177 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TTR P02766 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
PGAM1 P18669 1/20 0.35
MMP3 P08254 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
SCHEMBL779332 0.83 MYC (0.40) MYCHSD11B1MMP1MMP2MMP9
SCHEMBL29353004 0.83 HSD11B1 (0.47) MYCHSD11B1MMP1MMP2MMP9
SCHEMBL27852913 0.83 HSD11B1 (0.47) MYCHSD11B1MMP1MMP2MMP9
SCHEMBL9098597 0.83 MYC (0.44) MYCHSD11B1MMP1MMP2MMP9
SCHEMBL29617 0.83 HSD11B1 (0.47) MYCHSD11B1MMP1MMP2MMP9
Ammonia Solution, Strong SCHEMBL340600 0.82 HSD11B1 (0.46) MYCHSD11B1MMP1MMP2MMP9
SCHEMBL1589069 0.82 HSD11B1 (0.46) MYCHSD11B1MMP1MMP2MMP9
Calcium SCHEMBL31265402 0.82 HSD11B1 (0.46) MYCHSD11B1MMP1MMP2MMP9
SCHEMBL22345145 0.82 HSD11B1 (0.46) MYCHSD11B1MMP1MMP2MMP9
SCHEMBL5692778 0.82 HSD11B1 (0.50) MYCHSD11B1MMP1MMP2MMP9

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