SCHEMBL3176137

SCHEMBL3176137

CCC(=O)NS(=O)(=O)c1ccc(Oc2ncnc(OC3CCN(OC(=O)OC(C)C)CC3)c2C)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.62
CYP2C9 P11712 3/20 0.62
KCNH2 Q12809 1/20 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
SCHEMBL389577 0.89 GPR119 (0.78) GPR119CYP2C9KCNH2
SCHEMBL3164563 0.89 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL3164007 0.88 GPR119 (0.79) GPR119CYP2C9KCNH2
SCHEMBL3174959 0.88 GPR119 (0.68) GPR119CYP2C9KCNH2
SCHEMBL3161673 0.85 GPR119 (0.62) GPR119CYP2C9
SCHEMBL3173226 0.84 GPR119 (0.61) GPR119CYP2C9KCNH2
SCHEMBL3162157 0.83 GPR119 (0.61) GPR119CYP2C9
SCHEMBL3164419 0.82 GPR119 (0.60) GPR119CYP2C9
SCHEMBL3155250 0.82 GPR119 (0.60) GPR119CYP2C9
SCHEMBL3160860 0.82 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 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