SCHEMBL10179635

SCHEMBL10179635

CC(C)c1cccc(S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.54
KAT6A Q92794 1/20 0.50
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.47
HDAC4 P56524 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
KDM4E B2RXH2 2/20 0.47
MDM4 O15151 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
TYR P14679 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
CA5A P35218 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL11300578 0.94 SMN1; SMN2 (0.52) HTR6KAT6AALDH1A1SMN1; SMN2MAPT
SCHEMBL10192332 0.84 HDAC4 (0.54) HTR6KAT6AALDH1A1SMN1; SMN2MAPT
SCHEMBL27870611 0.82 PTGS2 (0.57) HTR6ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4616465 0.82 ALDH1A1 (0.61) HTR6ALDH1A1SMN1; SMN2MAPTPOLB
SCHEMBL27705682 0.81 HTR6 (0.45) HTR6KAT6AALDH1A1SMN1; SMN2MAPT
SCHEMBL27705670 0.81 SMN1; SMN2 (0.45) HTR6KAT6AALDH1A1SMN1; SMN2MAPT
SCHEMBL22925825 0.81 NAMPT (0.46) HTR6KAT6AALDH1A1SMN1; SMN2MAPT
SCHEMBL1882668 0.81 SMN1; SMN2 (0.45) HTR6KAT6AALDH1A1SMN1; SMN2MAPT
SCHEMBL25487141 0.80 KAT6A (0.45) KAT6AALDH1A1SMN1; SMN2MAPTHDAC4
SCHEMBL84445 0.80 ALDH1A1 (0.47) KAT6AALDH1A1SMN1; SMN2MAPTHDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130244122-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME ONUKI MASAMICHI (JP) 2013-09-19 US disclosed
US-20120219866-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-30 US disclosed
EP-2475041-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE BATTERY COMPRISING SAME Mitsubishi Chemical Corporation (JP) 2012-07-11 EP disclosed