SCHEMBL10179705

SCHEMBL10179705

CCCCc1ccc(S(=O)(=O)CC)cc1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
PSIP1 O75475 2/20 0.59
FFAR1 O14842 1/20 0.53
FFAR4 Q5NUL3 1/20 0.53
MLNR O43193 1/20 0.52
CA1 P00915 2/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
CA12 O43570 1/20 0.51
CA9 Q16790 1/20 0.51
TSHR P16473 1/20 0.51
HPGD P15428 2/20 0.50
ALDH1A1 P00352 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GAA P10253 1/20 0.50
CNR2 P34972 1/20 0.49
AKT1 P31749 1/20 0.48

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
SCHEMBL10182183 0.87 CA2 (0.67) CA2SMN1; SMN2PSIP1FFAR4LMNA
SCHEMBL10791903 0.85 CA2 (0.71) CA2SMN1; SMN2FFAR1FFAR4CA1
SCHEMBL96073 0.84 PSIP1 (0.55) CA2SMN1; SMN2PSIP1FFAR1FFAR4
SCHEMBL30026758 0.84 CA2 (0.65) CA2SMN1; SMN2PSIP1CA1CA12
SCHEMBL27366281 0.83 CA2 (0.69) CA2SMN1; SMN2FFAR1FFAR4CA1
SCHEMBL7216900 0.83 CA2 (0.69) CA2SMN1; SMN2FFAR1FFAR4CA1
SCHEMBL96074 0.82 CA2 (0.66) CA2SMN1; SMN2PSIP1CA1CA12
SCHEMBL10181021 0.82 CA2 (0.57) CA2SMN1; SMN2PSIP1FFAR1FFAR4
SCHEMBL10179403 0.82 CA2 (0.57) CA2SMN1; SMN2PSIP1FFAR1FFAR4
SCHEMBL10181565 0.82 CA2 (0.57) CA2SMN1; SMN2FFAR1FFAR4MLNR

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 4 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
WO-2007065683-A1 ARYL ACETIC ACID AND ESTER DERIVATIVES AND THEIR USES AS ANTIINFLAMMATORY NOVARTIS AG (CH) 2007-06-14 WO disclosed