SCHEMBL2667142

SCHEMBL2667142

CN1CCOc2c(ccc(Oc3cc(O)cc(C(=O)Nc4ccn(C(=O)OC(C)(C)C)n4)c3)c2Cl)C1=O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 3/20 0.36
CPT1B Q92523 3/20 0.36
ACACB O00763 3/20 0.34
GCK P35557 8/20 0.33
KCNH2 Q12809 6/20 0.32
PIK3CA P42336 1/20 0.31
ALPL P05186 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
SCHEMBL2667145 0.89 GCK (0.41) CPT1ACPT1BACACBGCKKCNH2
SCHEMBL1775504 0.88 GCK (0.48) CPT1ACPT1BACACBGCKKCNH2
SCHEMBL9072424 0.82 GCK (0.41) ACACBGCKKCNH2
SCHEMBL1776034 0.79 GCK (0.54) GCKKCNH2
SCHEMBL2667132 0.79 ACACB (0.40) CPT1ACPT1BACACBALPL
SCHEMBL2667144 0.79 ACACB (0.39) CPT1ACPT1BACACBALPL
SCHEMBL1776159 0.78 GCK (0.56) GCKKCNH2
SCHEMBL1776632 0.77 GCK (0.48) GCKKCNH2
SCHEMBL1775130 0.77 GCK (0.57) GCKKCNH2
SCHEMBL1775249 0.76 GCK (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006125972-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2006-11-30 WO disclosed