SCHEMBL9070813

SCHEMBL9070813

COC[C@@H](C)Oc1cc(C(=O)Nc2ccc(CC(=O)OC)cn2)cc(Oc2ccc(C(=O)N3CCN(C)CC3)cn2)n1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCK P35557 19/20 0.55
KCNH2 Q12809 2/20 0.46
PRKAA2 P54646 1/20 0.45
RARA P10276 1/20 0.45
RARB P10826 1/20 0.45
RARG P13631 1/20 0.44

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
SCHEMBL2667480 0.93 PRKAA2 (0.48) GCKKCNH2PRKAA2RARARARB
SCHEMBL2667347 0.92 GCK (0.54) GCKKCNH2PRKAA2RARARARB
SCHEMBL9071030 0.92 GCK (0.54) GCKKCNH2PRKAA2RARARARB
SCHEMBL9070814 0.90 GCK (0.59) GCKKCNH2RARARARBRARG
SCHEMBL9070907 0.87 GCK (0.53) GCKKCNH2PRKAA2RARARARB
SCHEMBL9070945 0.87 GCK (0.51) GCKKCNH2PRKAA2RARARARB
SCHEMBL9071054 0.86 GCK (0.61) GCKKCNH2RARARARB
SCHEMBL2667972 0.86 GCK (0.59) GCKKCNH2RARARARBRARG
SCHEMBL2667581 0.85 GCK (0.49) GCKRARARARBRARG
SCHEMBL2667977 0.85 GCK (0.46) GCKPRKAA2RARARARBRARG

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