SCHEMBL10180701

SCHEMBL10180701

CC(C)Cc1ccccc1S(=O)(=O)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 6/20 0.45
HPGD P15428 2/20 0.45
MAPT P10636 3/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LOX P28300 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MTOR P42345 1/20 0.40
FAAH O00519 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
ELANE P08246 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
SCHEMBL10180745 0.82 GABRA1 (0.44) LOXL2ELANECA2
SCHEMBL10180368 0.82 TSHR (0.56) TSHRSMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL10180047 0.78 TSHR (0.51) TSHRSMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL10180071 0.77 SLC6A2 (0.49) MEN1KMT2ALOXELANECA2
SCHEMBL10181390 0.77 GABRA1 (0.39) ALDH1A1HPGDELANECA2
SCHEMBL10180179 0.76 TSHR (0.53) TSHRSMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL10181925 0.76 MMP2 (0.47) PTGDR2KMT2ACA2
SCHEMBL10180394 0.75 ALDH1A1 (0.43) ALDH1A1MAPTKDM4EHTTMEN1
SCHEMBL12004593 0.75 TSHR (0.49) TSHRSMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL24879280 0.75 GABRA1 (0.44) ELANECA2

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