SCHEMBL16230445

SCHEMBL16230445

Cc1csc(Nc2ncc(Br)cc2Sc2ncc(CO)[nH]2)n1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCK P35557 17/20 0.48
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL1328660 0.79 GCK (0.56) GCKKDM4ENPC1HTTRAB9A
SCHEMBL1329911 0.78 GCK (0.46) GCKKDM4ENPC1HTTRAB9A
SCHEMBL1328809 0.76 GCK (0.64) GCKRAB9A
SCHEMBL1330791 0.74 GCK (0.53) GCKKDM4ENPC1HTTRAB9A
SCHEMBL2341148 0.73 GCK (0.59) GCKKDM4ENPC1HTTRAB9A
SCHEMBL1329654 0.73 GCK (0.57) GCKNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL1330143 0.72 GCK (0.58) GCKKDM4ENPC1HTTRAB9A
SCHEMBL16467487 0.71 GCK (0.47) GCKKDM4ENPC1HTTRAB9A
SCHEMBL1331445 0.71 GCK (0.52) GCKKDM4ENPC1HTTRAB9A
SCHEMBL1330706 0.70 GCK (0.48) GCKKDM4ENPC1HTTRAB9A

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
US-8883828-B2 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC. (US) 2014-11-11 US disclosed