SCHEMBL3168366

SCHEMBL3168366

Cc1c(Nc2ccc(OCC3CCCO3)cc2F)ncnc1OC1CCN(OC(=O)OC(C)C)CC1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.53
CYP2C9 P11712 2/20 0.45
ACACB O00763 4/20 0.41

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
SCHEMBL389117 0.90 GPR119 (0.66) GPR119CYP2C9
SCHEMBL3165831 0.88 GPR119 (0.53) GPR119CYP2C9ACACB
SCHEMBL3164182 0.86 GPR119 (0.58) GPR119CYP2C9ACACB
SCHEMBL3165438 0.86 GPR119 (0.58) GPR119CYP2C9ACACB
SCHEMBL3167060 0.86 GPR119 (0.58) GPR119CYP2C9
SCHEMBL6362661 0.86 GPR119 (0.52) GPR119CYP2C9
SCHEMBL3167356 0.86 GPR119 (0.57) GPR119CYP2C9
SCHEMBL3161999 0.86 GPR119 (0.57) GPR119CYP2C9ACACB
SCHEMBL3169106 0.84 GPR119 (0.56) GPR119CYP2C9
SCHEMBL3164119 0.84 GPR119 (0.61) 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-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