SCHEMBL27935239

SCHEMBL27935239

Cc1csc(Nc2ncc(-c3cccs3)cc2Sc2ccccc2F)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
GCK P35557 14/20 0.42
RAB9A P51151 3/20 0.39
GAA P10253 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
ALOX12 P18054 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37

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
SCHEMBL27742604 0.88 GCK (0.45) SMN1; SMN2GCKRAB9AGAAKMT2A
SCHEMBL1328829 0.81 GCK (0.61) SMN1; SMN2GCKRAB9AGAAKMT2A
SCHEMBL27761676 0.72 RAB9A (0.52) SMN1; SMN2RAB9AGAAKMT2ANPC1
SCHEMBL27763161 0.70 GCK (0.57) SMN1; SMN2GCKRAB9AGAAKMT2A
SCHEMBL1329730 0.70 GCK (0.50) SMN1; SMN2GCKRAB9AGAAKMT2A
SCHEMBL1329654 0.70 GCK (0.57) SMN1; SMN2GCKRAB9AGAAKMT2A
SCHEMBL1328957 0.70 GCK (0.70) GCKRAB9AGAAKMT2AADORA2A
Hydrochloric Acid SCHEMBL1330168 0.69 GCK (0.69) GCKRAB9AGAAKMT2AADORA2A
SCHEMBL27741171 0.69 GCK (0.46) SMN1; SMN2GCKRAB9AGAAKMT2A
SCHEMBL1329776 0.69 GCK (0.61) GCKRAB9AGAAKMT2A

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
CN-101437816-B 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC 2013-08-14 CN claimed