SCHEMBL10179779

SCHEMBL10179779

C=CS(=O)(=O)Oc1ccc(C2CCCCC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
HTT P42858 1/20 0.43
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
KCNH2 Q12809 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
HAO1 Q9UJM8 1/20 0.39
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
TP53 P04637 1/20 0.38
ATM Q13315 1/20 0.38
CASP1 P29466 2/20 0.38
DRD2 P14416 1/20 0.38
DRD1 P21728 1/20 0.38
DRD4 P21917 1/20 0.38
DRD5 P21918 1/20 0.38
DRD3 P35462 1/20 0.38
KMT2A Q03164 2/20 0.37

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
SCHEMBL10180384 0.98 LMNA (0.41) LMNAHTTTHRBSMN1; SMN2KCNH2
SCHEMBL10180855 0.82 DRD2 (0.44) LMNAHTTSMN1; SMN2MAPTALDH1A1
SCHEMBL10180037 0.80 DRD2 (0.45) ALDH1A1DRD2DRD1DRD4DRD5
SCHEMBL10180237 0.80 LMNA (0.40) LMNAHTTTHRBSMN1; SMN2KCNH2
SCHEMBL10180204 0.78 DRD2 (0.39) LMNAHTTTHRBSMN1; SMN2KCNH2
SCHEMBL107194 0.78 LMNA (0.46) LMNAHTTTHRBSMN1; SMN2KCNH2
SCHEMBL9608741 0.78 ENPP3 (0.54) LMNAHTTTHRBSMN1; SMN2KCNH2
SCHEMBL10179977 0.76 ENPP3 (0.51) LMNAHTTTHRBSMN1; SMN2KCNH2
SCHEMBL9957803 0.75 ENPP3 (0.56) LMNAHTTTHRBSMN1; SMN2KCNH2
SCHEMBL9957718 0.75 DRD2 (0.60) LMNAHTTTHRBSMN1; SMN2KCNH2

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