SCHEMBL5201630

SCHEMBL5201630

CC(C)OC(=O)N1CCCCC1Oc1cc(Nc2cc(F)c(Br)cc2F)ncn1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.53
FLT3 P36888 3/20 0.34
CDK2 P24941 1/20 0.34
CDK6 Q00534 1/20 0.34
SCN9A Q15858 1/20 0.33
CYP2C9 P11712 3/20 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
SCHEMBL390051 0.85 GPR119 (0.71) GPR119CYP2C9
SCHEMBL4765631 0.79 GPR119 (0.56) GPR119FLT3CDK2CDK6SCN9A
SCHEMBL389552 0.78 GPR119 (0.75) GPR119CYP2C9
SCHEMBL1445594 0.77 GPR119 (0.40) GPR119CYP2C9
SCHEMBL386264 0.75 GPR119 (0.55) GPR119
SCHEMBL389519 0.74 GPR119 (0.70) GPR119CYP2C9
SCHEMBL386787 0.74 GPR119 (0.80) GPR119CYP2C9
SCHEMBL391379 0.73 GPR119 (0.69) GPR119CYP2C9
SCHEMBL390621 0.73 GPR119 (0.68) GPR119CYP2C9
SCHEMBL391698 0.73 GPR119 (0.68) GPR119CYP2C9

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-1758565-A2 COMBINATION THERAPY FOR THE TREATMENT OF DIABETES AND CONDITIONS RELATED THERETO AND FOR THE TREATMENT OF CONDITIONS AMELIORATED BY INCREASING A BLOOD GLP-1 LEVEL Arena Pharmaceuticals, Inc. (US) 2007-03-07 EP disclosed
WO-2006076231-A2 COMBINATION THERAPY FOR THE TREATMENT OF DIABETES AND CONDITIONS RELATED THERETO AND FOR THE TREATMENT OF CONDITIONS AMELIORATED BY INCREASING A BLOOD GLP-1 LEVEL ARENA PHARMACEUTICALS, INC. (US) 2006-07-20 WO disclosed