SCHEMBL1723302

SCHEMBL1723302

Cc1cnc(NC(=O)C(C)n2cc(S(C)(=O)=O)cn2)cn1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCK P35557 10/20 0.45
RXFP1 Q9HBX9 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNH2 Q12809 1/20 0.37
IDO1 P14902 1/20 0.36
NLRP3 Q96P20 1/20 0.35
NOTUM Q6P988 1/20 0.34
WNT1 P04628 4/20 0.34
GSK3B P49841 4/20 0.34
DYRK1A Q13627 4/20 0.34
MAPK1 P28482 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
SCHEMBL1725260 0.80 GCK (0.66) GCK
SCHEMBL1725261 0.80 GCK (0.66) GCK
SCHEMBL1722766 0.76 GCK (0.41) GCKIDO1
SCHEMBL1723258 0.73 GCK (0.40) GCKSMN1; SMN2KCNH2IDO1NOTUM
SCHEMBL2196405 0.72 GCK (0.62) GCK
SCHEMBL2196401 0.72 GCK (0.62) GCK
SCHEMBL26764538 0.71 NOTUM (0.46) SMN1; SMN2IDO1NOTUM
SCHEMBL2199446 0.71 GCK (0.57) GCK
SCHEMBL2199454 0.71 GCK (0.57) GCK
SCHEMBL839388 0.70 NOTUM (0.43) GCKSMN1; SMN2IDO1NOTUMMAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344458-A1 HETEROARYLS AMIDE DERIVATIVES AND THEIR USE AS GLUCOKINASE ACTIVATORS Pfizer Inc. (US) 2011-07-20 EP disclosed
WO-2010029461-A1 HETEROARYLS AMIDE DERIVATIVES AND THEIR USE AS GLUCOKINASE ACTIVATORS PFIZER INC. (US) 2010-03-18 WO disclosed