SCHEMBL190972

SCHEMBL190972

Cc1csc(Nc2cc(Oc3ccc4ncccc4c3)ccn2)n1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GCK P35557 11/20 0.47
GRM5 P41594 2/20 0.46
KCNN1 Q92952 1/20 0.46
KCNN2 Q9H2S1 1/20 0.46
KCNN3 Q9UGI6 1/20 0.46
SLC2A1 P11166 1/20 0.45
TRPV4 Q9HBA0 1/20 0.43
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
TGFBR1 P36897 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
Hydrochloric Acid SCHEMBL191626 0.91 GCK (0.47) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL190659 0.83 GCK (0.59) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL191056 0.82 TRPV4 (0.56) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL190754 0.82 GRM5 (0.67) GCKGRM5TRPV4TGFBR1
SCHEMBL192859 0.82 GCK (0.53) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL190670 0.81 MEN1 (0.54) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL191592 0.81 TRPV4 (0.56) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL191359 0.80 GRM5 (0.48) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL191025 0.80 GCK (0.51) GCKGRM5KCNN1KCNN2KCNN3
SCHEMBL190744 0.79 TRPV4 (0.47) GCKGRM5KCNN1KCNN2KCNN3

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