SCHEMBL9956924

SCHEMBL9956924

CS(=O)(=O)Oc1cccc(C2CCCCC2)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.63
DRD3 P35462 4/20 0.63
DRD1 P21728 3/20 0.47
DRD4 P21917 3/20 0.47
DRD5 P21918 3/20 0.47
KMO O15229 1/20 0.46
HTR2C P28335 2/20 0.45
HDAC4 P56524 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
ENPP3 O14638 1/20 0.43
ENPP1 P22413 1/20 0.43
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
XBP1 P17861 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HCRTR2 O43614 1/20 0.40

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
SCHEMBL10180417 0.98 DRD2 (0.64) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10180182 0.85 DRD2 (0.54) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10180704 0.83 DRD2 (0.55) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10180668 0.82 DRD2 (0.63) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10182052 0.81 DRD2 (0.54) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10180590 0.81 ALDH1A1 (0.57) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10180855 0.81 DRD2 (0.44) DRD2DRD3DRD1DRD4DRD5
SCHEMBL4823943 0.80 DRD2 (0.65) DRD2DRD3DRD1DRD4DRD5
SCHEMBL10180537 0.80 DRD2 (0.67) DRD2DRD3DRD1DRD4DRD5
SCHEMBL9608741 0.80 ENPP3 (0.54) DRD2DRD3DRD1DRD4DRD5

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-9029024-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-05-12 US disclosed
EP-2469638-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTROCHEMICAL DEVICE USING THE SAME UBE INDUSTRIES (JP) 2014-10-01 EP disclosed
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
US-20120189919-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-26 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
EP-2469638-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-06-27 EP disclosed