SCHEMBL5219356

SCHEMBL5219356

CS(=O)(=O)c1ccc([C@@H](CC2CCCC2)C(=O)Nc2cnc(C(O)CN)cn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.64
GCK P35557 17/20 0.60

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
SCHEMBL2652923 0.86 GCK (0.59) KCNH2GCK
SCHEMBL12742382 0.86 GCK (0.64) KCNH2GCK
SCHEMBL9892933 0.84 GCK (0.62) KCNH2GCK
SCHEMBL1133220 0.83 GCK (0.59) KCNH2GCK
SCHEMBL1137113 0.83 KCNH2 (0.55) KCNH2GCK
SCHEMBL2645769 0.82 GCK (0.60) KCNH2GCK
SCHEMBL2645766 0.82 GCK (0.60) KCNH2GCK
SCHEMBL2668947 0.82 GCK (0.60) KCNH2GCK
SCHEMBL2664457 0.81 GCK (0.57) KCNH2GCK
SCHEMBL2646843 0.81 GCK (0.63) KCNH2GCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572670-B1 5-SUBSTITUTED-PYRAZINE OR -PYRIDINE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2007-08-22 EP claimed