SCHEMBL190732

SCHEMBL190732

Cc1csc(Nc2cc(Oc3cccc4cnccc34)ccn2)n1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCK P35557 12/20 0.47
GRM5 P41594 2/20 0.46
CCR4 P51679 2/20 0.42
BRAF P15056 1/20 0.41
TRPV4 Q9HBA0 1/20 0.41
KCNN1 Q92952 1/20 0.40
KCNN2 Q9H2S1 1/20 0.40
KCNN3 Q9UGI6 1/20 0.40

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
SCHEMBL190775 0.89 GCK (0.53) GCKCCR4TRPV4KCNN1KCNN2
SCHEMBL192859 0.82 GCK (0.53) GCKGRM5CCR4KCNN1KCNN2
SCHEMBL191359 0.81 GRM5 (0.48) GCKGRM5TRPV4KCNN1KCNN2
SCHEMBL190754 0.81 GRM5 (0.67) GCKGRM5TRPV4
SCHEMBL190435 0.81 GAA (0.56) GCKTRPV4KCNN1KCNN2KCNN3
SCHEMBL191828 0.80 GCK (0.54) GCKGRM5TRPV4KCNN1KCNN2
SCHEMBL190467 0.80 GCK (0.54) GCKGRM5TRPV4KCNN1KCNN2
SCHEMBL190744 0.78 TRPV4 (0.47) GCKGRM5CCR4TRPV4KCNN1
SCHEMBL190659 0.78 GCK (0.59) GCKGRM5TRPV4KCNN1KCNN2
SCHEMBL12305690 0.78 GCK (0.47) GCKGRM5TRPV4KCNN1KCNN2

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-1986645-B1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC (US) 2012-01-04 EP disclosed