SCHEMBL10180357

SCHEMBL10180357

O=S(=O)(Cc1ccccc1)c1cccc(C2CCCC2)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.52
HTR6 P50406 1/20 0.51
KMO O15229 1/20 0.44
DRD3 P35462 4/20 0.42
SIGMAR1 Q99720 1/20 0.42
HSD17B10 Q99714 2/20 0.42
HDAC4 P56524 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
TSHR P16473 1/20 0.42
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 1/20 0.41
DAO P14920 1/20 0.40
CYP2D6 P10635 1/20 0.39
DRD1 P21728 1/20 0.39
DRD4 P21917 1/20 0.39
DRD5 P21918 1/20 0.39

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
SCHEMBL10181271 0.99 DRD2 (0.51) DRD2HTR6KMODRD3SIGMAR1
SCHEMBL10180166 0.83 HSD17B10 (0.53) HTR6HSD17B10TSHRUSP2HPGD
SCHEMBL10179715 0.82 HSD17B10 (0.51) HTR6HSD17B10TSHRUSP2HPGD
SCHEMBL14598176 0.82 MAPT (0.50) HTR6HSD17B10TSHRUSP2HPGD
SCHEMBL10179622 0.81 DRD2 (0.54) DRD2KMODRD3SIGMAR1HDAC4
SCHEMBL10179579 0.80 DRD2 (0.53) DRD2KMODRD3SIGMAR1HDAC4
SCHEMBL10180085 0.80 KMO (0.50) DRD2HTR6KMODRD3SIGMAR1
SCHEMBL10179939 0.78 KMO (0.53) DRD2HTR6KMODRD3SIGMAR1
SCHEMBL10181962 0.77 HDAC4 (0.51) DRD2HTR6KMODRD3SIGMAR1
SCHEMBL10180455 0.77 DRD2 (0.44) DRD2KMODRD3SIGMAR1HDAC4

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