SCHEMBL6066337

SCHEMBL6066337

Cc1nc(Cl)ccc1Nc1ncnc(OC2CCCCN2C(=O)OC(C)C)c1C

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.58
CYP2C9 P11712 3/20 0.58
KCNH2 Q12809 1/20 0.50

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
SCHEMBL387953 0.85 GPR119 (0.77) GPR119CYP2C9KCNH2
SCHEMBL290305 0.80 GPR119 (0.45) GPR119CYP2C9
SCHEMBL5823934 0.80 GPR119 (0.77) GPR119CYP2C9KCNH2
SCHEMBL3164074 0.79 GPR119 (0.61) GPR119CYP2C9KCNH2
SCHEMBL6456096 0.76 GPR119 (0.54) GPR119CYP2C9KCNH2
SCHEMBL5133272 0.75 GPR119 (0.60) GPR119CYP2C9KCNH2
SCHEMBL1445594 0.74 GPR119 (0.40) GPR119CYP2C9
SCHEMBL1712505 0.73 GPR119 (1.00) GPR119CYP2C9KCNH2
SCHEMBL389215 0.73 GPR119 (0.71) GPR119CYP2C9KCNH2
SCHEMBL386714 0.72 GPR119 (0.72) GPR119CYP2C9KCNH2

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-1644357-A1 TRISUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2006-04-12 EP disclosed
WO-2005007647-A1 TRISUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2005-01-27 WO disclosed