SCHEMBL3249631

SCHEMBL3249631

COc1c(Nc2ccc(S(C)(=O)=O)cc2F)ncnc1OC1CCN(OC(=O)OC(C)C)CC1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.66
CYP2C9 P11712 5/20 0.57
KCNH2 Q12809 2/20 0.57

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
SCHEMBL3252207 0.92 GPR119 (0.59) GPR119CYP2C9KCNH2
SCHEMBL3174766 0.91 GPR119 (0.80) GPR119CYP2C9KCNH2
SCHEMBL389648 0.89 GPR119 (0.83) GPR119CYP2C9KCNH2
SCHEMBL3257047 0.89 GPR119 (0.55) GPR119CYP2C9KCNH2
SCHEMBL3170972 0.88 GPR119 (0.65) GPR119CYP2C9KCNH2
SCHEMBL3161229 0.87 GPR119 (0.64) GPR119CYP2C9KCNH2
SCHEMBL3164582 0.87 GPR119 (0.63) GPR119CYP2C9KCNH2
SCHEMBL3257084 0.86 GPR119 (0.55) GPR119CYP2C9KCNH2
SCHEMBL3164107 0.85 GPR119 (0.61) GPR119CYP2C9KCNH2
SCHEMBL3246517 0.84 GPR119 (0.80) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1911756-B9 Substituted pyridinyl and pyrimidinyl derivatives as modulators of metabolism and the treatment of disorders related thereto ARENA PHARM INC (US) 2010-05-26 EP claimed
EP-1911756-B1 Substituted pyridinyl and pyrimidinyl derivatives as modulators of metabolism and the treatment of disorders related thereto ARENA PHARM INC (US) 2009-10-21 EP claimed
EP-1732562-B1 SUBSTITUTED PYRIDINYL AND PYRIMIDINYL DERIVATIVES AS MODULATORS OF METABOLISM AND THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2007-12-19 EP claimed