SCHEMBL3170975

SCHEMBL3170975

Cc1cc(N2CCOCC2)ncc1Nc1ncnc(OC2CCN(OC(=O)OC(C)C)CC2)c1C

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.56
CYP2C9 P11712 2/20 0.45
ERBB2 P04626 3/20 0.42
ACACB O00763 1/20 0.40
KCNH2 Q12809 1/20 0.39

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
SCHEMBL390399 0.89 GPR119 (0.71) GPR119CYP2C9KCNH2
SCHEMBL3170627 0.86 GPR119 (0.56) GPR119CYP2C9KCNH2
SCHEMBL3159956 0.86 GPR119 (0.61) GPR119CYP2C9KCNH2
SCHEMBL3170405 0.84 GPR119 (0.52) GPR119CYP2C9KCNH2
SCHEMBL3170510 0.83 GPR119 (0.57) GPR119CYP2C9KCNH2
SCHEMBL3169807 0.81 GPR119 (0.56) GPR119CYP2C9KCNH2
SCHEMBL6065686 0.81 GPR119 (0.46) GPR119CYP2C9ERBB2
SCHEMBL6456096 0.81 GPR119 (0.54) GPR119CYP2C9ERBB2KCNH2
SCHEMBL3164182 0.79 GPR119 (0.58) GPR119CYP2C9ACACBKCNH2
SCHEMBL3160646 0.78 GPR119 (0.57) 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-B9 TRISUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2010-03-24 EP claimed
EP-1644357-B1 TRISUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2007-12-12 EP claimed