SCHEMBL14423909

SCHEMBL14423909

Cc1cnc(NC(=O)/C(=C/C2CCCC2)c2ccc(S(C)(=O)=O)cn2)s1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
GCK P35557 3/20 0.46
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
GAA P10253 1/20 0.43
ATR Q13535 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.38
PRNP P04156 1/20 0.38
PKM P14618 1/20 0.38
CLK1 P49759 1/20 0.36

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
SCHEMBL2654461 0.89 GCK (0.46) GCK
SCHEMBL2654465 0.89 GCK (0.46) GCK
SCHEMBL2653794 0.85 GCK (0.64) SMN1; SMN2GCKGAAMEN1KMT2A
SCHEMBL2653788 0.85 GCK (0.64) SMN1; SMN2GCKGAAMEN1KMT2A
SCHEMBL2646460 0.77 GCK (0.59) GCKKMT2A
SCHEMBL2646462 0.77 GCK (0.59) GCKKMT2A
SCHEMBL2645565 0.77 GCK (0.58) GCKKMT2ACLK1
SCHEMBL2645561 0.77 GCK (0.58) GCKKMT2ACLK1
SCHEMBL2021805 0.77 GCK (0.53) SMN1; SMN2GCKRAB9ANPC1GAA
SCHEMBL1024394 0.77 GCK (0.53) SMN1; SMN2GCKRAB9ANPC1GAA

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-7262196-B2 Tri(cyclo) substituted amide glucokinase activator compounds PROSIDION LIMITED (GB) 2007-08-28 US disclosed