SCHEMBL9070944

SCHEMBL9070944

CC(C)Oc1cc(C(=O)NC(=N)S)cc(Oc2ccc(C(=O)N3CCCC3)cn2)n1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCK P35557 3/20 0.46
HRH3 Q9Y5N1 15/20 0.45
OPRM1 P35372 1/20 0.41
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 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
SCHEMBL9070903 0.98 GCK (0.48) GCKHRH3
SCHEMBL9070902 0.93 HRH3 (0.46) GCKHRH3
SCHEMBL2667566 0.92 HRH3 (0.43) GCKHRH3
SCHEMBL2667693 0.88 GCK (0.47) GCKMEN1GAAHTTKMT2A
SCHEMBL2667997 0.86 GCK (0.49) GCKHRH3MEN1GAAHTT
SCHEMBL9071015 0.83 GCK (0.50) GCKHRH3
SCHEMBL2667976 0.83 F10 (0.37) GCK
SCHEMBL9070947 0.83 GCK (0.53) GCK
SCHEMBL9070942 0.81 GCK (0.49) GCKHRH3OPRM1
SCHEMBL2667387 0.81 GCK (0.55) GCK

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