SCHEMBL10180787

SCHEMBL10180787

CCCCCc1cccc(OS(=O)(=O)Cc2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.59
PPARA Q07869 7/20 0.54
PPARG P37231 5/20 0.54
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
MGLL Q99685 1/20 0.46
FUT7 Q11130 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL10179654 0.90 KMT2A (0.57) KMT2APPARAPPARGCA1CA2
SCHEMBL10180571 0.88 PPARA (0.56) PPARAPPARGCA1CA2CA9
SCHEMBL10179932 0.86 PPARA (0.53) PPARAPPARGCA1CA2CA9
SCHEMBL10180775 0.86 KMT2A (0.63) KMT2ACA1CA2CA9MGLL
SCHEMBL10179888 0.83 PPARA (0.54) PPARAPPARGCA1CA2CA9
SCHEMBL29159395 0.82 PPARA (0.59) PPARAPPARGCA1CA2CA9
SCHEMBL10179751 0.82 PPARA (0.56) PPARAPPARGCA1CA2CA9
SCHEMBL10181555 0.82 PPARA (0.56) PPARAPPARGCA1CA2CA9
SCHEMBL29159397 0.81 PPARA (0.58) PPARAPPARGCA1CA2CA9
SCHEMBL29159399 0.81 PPARA (0.58) PPARAPPARGCA1CA2CA9

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