SCHEMBL2649604

SCHEMBL2649604

COC(=O)/C(=C/C1CCCC1)c1ccc(S(C)(=O)=O)c(C2(C)N=NN=N2)c1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCK P35557 4/20 0.38
VCAM1 P19320 1/20 0.31
KMT2A Q03164 2/20 0.31
THRB P10828 2/20 0.31
PPARG P37231 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
VDR P11473 1/20 0.30

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
SCHEMBL2650789 0.92 GCK (0.36) GCKKMT2AL3MBTL1
SCHEMBL2651148 0.83 GCK (0.35) GCKKMT2A
SCHEMBL2650928 0.82 TAS1R3 (0.32)
SCHEMBL2650347 0.82 GCK (0.34) GCKKMT2A
SCHEMBL2649681 0.82 GCK (0.34) GCKKMT2A
SCHEMBL2650499 0.81 GCK (0.35) GCK
SCHEMBL2649950 0.80 TAS1R3 (0.34)
SCHEMBL2645570 0.80 GCK (0.40) GCKVCAM1KMT2ATHRBPPARG
SCHEMBL2645574 0.80 GCK (0.40) GCKVCAM1KMT2ATHRBPPARG
SCHEMBL2645675 0.76 CNR2 (0.39) GCK

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-1311504-A1 TETRAZOLYL-PHENYL ACETAMIDE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 EP disclosed
WO-2002014312-A1 TETRAZOLYL-PHENYL ACETAMIDE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 WO disclosed