SCHEMBL2652932

SCHEMBL2652932

CS(=O)(=O)c1ccc([C@@H](CC2CCCC2)C(=O)Nc2cnc(CC=NO)cn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 17/20 0.57
KCNH2 Q12809 3/20 0.51

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
SCHEMBL2653925 0.88 GCK (0.52) GCKKCNH2
SCHEMBL2653936 0.87 KCNH2 (0.70) GCKKCNH2
SCHEMBL2653939 0.87 KCNH2 (0.70) GCKKCNH2
SCHEMBL12742382 0.85 GCK (0.64) GCKKCNH2
SCHEMBL4917790 0.85 GCK (0.58) GCKKCNH2
SCHEMBL2668947 0.83 GCK (0.60) GCKKCNH2
SCHEMBL9892933 0.83 GCK (0.62) GCKKCNH2
SCHEMBL2644021 0.83 GCK (0.58) GCKKCNH2
SCHEMBL2644017 0.83 GCK (0.58) GCKKCNH2
SCHEMBL2664485 0.83 GCK (0.58) GCKKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572670-A1 5-SUBSTITUTED-PYRAZINE OR -PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-14 EP claimed
WO-2004052869-A1 5-SUBSTITUTED-PYRAZINE OR PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2004-06-24 WO claimed
EP-1572670-A1 5-SUBSTITUTED-PYRAZINE OR -PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-14 EP disclosed
WO-2004052869-A1 5-SUBSTITUTED-PYRAZINE OR PYRIDINE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2004-06-24 WO disclosed