SCHEMBL9070837

SCHEMBL9070837

COC(=O)Cc1ccc(NC(=O)c2cc(Oc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)nc(OC(C)C)c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCK P35557 4/20 0.43
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTGDR Q13258 5/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GSK3B P49841 1/20 0.40
KDM4E B2RXH2 1/20 0.40
THRB P10828 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
SCHEMBL2667993 0.94 L3MBTL1 (0.47) GCKKCNH2ALDH1A1POLBL3MBTL1
SCHEMBL2667368 0.94 GCK (0.48) GCKKCNH2ALDH1A1PTGDRL3MBTL1
SCHEMBL2667732 0.92 GCK (0.46) GCKKCNH2ALDH1A1SMN1; SMN2POLB
SCHEMBL9070838 0.88 GCK (0.52) GCKALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL9070926 0.87 PRKAA2 (0.46) GCKKCNH2
SCHEMBL2667579 0.87 GCK (0.51) GCKKCNH2L3MBTL1
SCHEMBL2667687 0.87 GCK (0.51) GCKKCNH2L3MBTL1
SCHEMBL2667442 0.87 GCK (0.57) GCKKCNH2
SCHEMBL9071038 0.86 GCK (0.48) GCK
SCHEMBL9071013 0.85 GCK (0.49) GCKKCNH2ALDH1A1SMN1; SMN2POLB

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
WO-2009083553-A1 AZINE COMPOUNDS AS GLUCOKINASE ACTIVATORS RHEOSCIENCE A/S (DK) 2009-07-09 WO disclosed