SCHEMBL4424820

SCHEMBL4424820

CS(=O)(=O)c1cc(F)c(-n2nnc3c(OC4CCN(C(=O)O)CC4)ncnc32)cc1F

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.55
CYP2C9 P11712 2/20 0.46
KCNH2 Q12809 1/20 0.46

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
SCHEMBL386358 0.89 GPR119 (0.59) GPR119CYP2C9KCNH2
SCHEMBL5274347 0.88 GPR119 (0.60) GPR119CYP2C9KCNH2
SCHEMBL390135 0.83 GPR119 (0.54) GPR119CYP2C9KCNH2
SCHEMBL390411 0.79 GPR119 (0.58) GPR119
SCHEMBL388955 0.78 GPR119 (0.75) GPR119CYP2C9KCNH2
SCHEMBL4328393 0.77 GPR119 (0.48) GPR119CYP2C9KCNH2
SCHEMBL386087 0.77 GPR119 (0.45) GPR119CYP2C9KCNH2
SCHEMBL390700 0.76 GPR119 (0.57) GPR119CYP2C9KCNH2
SCHEMBL389390 0.74 GPR119 (0.80) GPR119CYP2C9KCNH2
SCHEMBL390832 0.74 GPR119 (0.65) 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-1758565-B2 Method of identifying GLP-1 secretagogues ARENA PHARM INC (US) 2012-11-14 EP disclosed
EP-1758565-B1 Method of identifying GLP-1 secretagogues ARENA PHARM INC (US) 2009-05-13 EP disclosed