SCHEMBL10179980

SCHEMBL10179980

Cc1ccc(S(=O)(=O)Oc2ccccc2C2CCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.63
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ESR1 P03372 1/20 0.48
GAA P10253 1/20 0.48
ESR2 Q92731 1/20 0.48
PTGS2 P35354 1/20 0.45
HPGD P15428 1/20 0.45
ALDH1A1 P00352 2/20 0.44
ENPP3 O14638 2/20 0.44
ENPP1 P22413 2/20 0.44
ENPP2 Q13822 2/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL9958221 0.99 HTR6 (0.62) HTR6LMNAMAPK1MEN1KMT2A
SCHEMBL10179914 0.88 HTR6 (0.59) HTR6ALDH1A1ENPP3ENPP1ENPP2
SCHEMBL10181573 0.87 HTR6 (0.58) HTR6PTGS2ALDH1A1ENPP3ENPP1
Hydrogen Sulfide SCHEMBL22631538 0.85 HTR6 (0.60) HTR6LMNAMAPK1MEN1KMT2A
SCHEMBL2047191 0.81 HTR6 (0.47) HTR6LMNAMAPK1MEN1KMT2A
SCHEMBL17320652 0.79 HTR6 (0.52) HTR6LMNAMAPK1MEN1KMT2A
SCHEMBL10180799 0.79 PTGDR2 (0.49) HTR6MEN1KMT2APTGS2
SCHEMBL8501386 0.78 HTR6 (0.51) HTR6LMNAMAPK1MEN1KMT2A
SCHEMBL9957566 0.77 PTGDR2 (0.51) HTR6MEN1KMT2APTGS2ENPP3
SCHEMBL2044267 0.76 HTR6 (0.50) HTR6LMNAMAPK1MEN1KMT2A

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