SCHEMBL4719718

SCHEMBL4719718

CC(C)OC(=O)ON1CCC(Oc2cc(Nc3ccc(S(C)(=O)=O)cc3F)ncn2)CC1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.79
CYP2C9 P11712 3/20 0.48
KCNH2 Q12809 1/20 0.47

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
SCHEMBL4718845 0.90 GPR119 (0.63) GPR119CYP2C9
SCHEMBL4719030 0.89 GPR119 (0.67) GPR119CYP2C9
SCHEMBL288892 0.89 GPR119 (1.00) GPR119CYP2C9KCNH2
SCHEMBL4721616 0.88 GPR119 (0.62) GPR119CYP2C9KCNH2
SCHEMBL4720557 0.88 GPR119 (0.61) GPR119CYP2C9
SCHEMBL4722464 0.88 GPR119 (0.60) GPR119CYP2C9
SCHEMBL4722426 0.87 GPR119 (0.60) GPR119CYP2C9KCNH2
SCHEMBL4720782 0.86 GPR119 (0.58) GPR119CYP2C9
SCHEMBL4722205 0.86 GPR119 (0.59) GPR119CYP2C9
SCHEMBL4719427 0.86 GPR119 (0.59) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756084-B1 SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2008-11-26 EP claimed