SCHEMBL2656784

SCHEMBL2656784

CCc1cc(C)ccc1S(=O)(=O)OS(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.37
TSHR P16473 3/20 0.37
HSD17B10 Q99714 2/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
F2 P00734 1/20 0.34
MAPK1 P28482 1/20 0.34
POLB P06746 2/20 0.33
MCOLN3 Q8TDD5 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MEP1B Q16820 2/20 0.32
NR3C1 P04150 1/20 0.32

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
SCHEMBL16637942 0.89 KDM4E (0.35) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL21388018 0.82 TSHR (0.41) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL29624394 0.82 TSHR (0.41) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL15018736 0.81 RAPGEF4 (0.38) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL28823865 0.81 RAPGEF4 (0.38) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL15965543 0.80 L3MBTL1 (0.42) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL17895348 0.79 RAPGEF4 (0.37) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL4138945 0.77 RAPGEF4 (0.42) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL20599543 0.77 RAPGEF4 (0.35) RAPGEF4TSHRHSD17B10CASP1CASP7
SCHEMBL10995940 0.76 LMNA (0.44) RAPGEF4TSHRHSD17B10CASP1CASP7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2157859-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE Takeda Pharmaceutical Company Limited (JP) 2010-03-03 EP disclosed
WO-2008156757-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-24 WO disclosed