SCHEMBL27889595

SCHEMBL27889595

CC(=O)Oc1cnc2[nH]ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.52
▸ F2 P00734 1/20 0.52
▸ GLA P06280 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ CDK8 P49336 11/20 0.51
▸ KDR P35968 2/20 0.51
▸ CDK7 P50613 2/20 0.51
▸ PLK4 O00444 1/20 0.51
▸ DCLK1 O15075 1/20 0.51
▸ ROCK2 O75116 1/20 0.51
▸ PRKD3 O94806 1/20 0.51
▸ MAP4K4 O95819 1/20 0.51
▸ PAK4 O96013 1/20 0.51
▸ CHEK2 O96017 1/20 0.51
▸ INSR P06213 1/20 0.51
▸ CDK1 P06493 1/20 0.51
▸ FES P07332 1/20 0.51
▸ ROS1 P08922 1/20 0.51
▸ PDGFRB P09619 1/20 0.51
▸ PDGFRA P16234 1/20 0.51

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
SCHEMBL14856741 0.89 CDK8 (0.49) CDK8KDRCDK7PLK4DCLK1
SCHEMBL24775576 0.83 KDR (0.46) CDK8KDRCDK7PLK4DCLK1
SCHEMBL296198 0.78 KDR (0.65) CDK8KDRCDK7PLK4DCLK1
SCHEMBL19867723 0.78 KDR (0.47) CDK8KDRCDK7PLK4DCLK1
SCHEMBL27223191 0.77 RIPK1 (0.47) CDK8KDRCDK7PLK4DCLK1
SCHEMBL413709 0.76 KDR (0.54) CDK8KDRCDK7PLK4DCLK1
SCHEMBL12410716 0.76 CDK8 (0.67) CDK8KDRCDK7PLK4DCLK1
SCHEMBL15416483 0.75 GLA (0.49) ALDH1A1F2GLAHPGDKDR
SCHEMBL27927096 0.75 ALDH1A1 (0.52) ALDH1A1F2GLAHPGDPIK3C3
SCHEMBL24896303 0.75 CDK8 (0.50) CDK8KDRCDK7PLK4DCLK1

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
CN-102686587-B Azaindole glucokinase activators HOFFMANN LA ROCHE 2015-05-27 — — CN disclosed
CN-102686587-A Azaindole glucokinase activators HOFFMANN LA ROCHE 2012-09-19 — — CN disclosed
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