SCHEMBL3256352

SCHEMBL3256352

COc1c(Nc2ccc(CCS(C)(=O)=O)nc2C)ncnc1OC1CCN(OC(=O)OC(C)C)CC1

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 0.62

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
SCHEMBL3253085 0.91 GPR119 (0.59) GPR119CYP2C9KCNH2
SCHEMBL3246678 0.91 GPR119 (0.58) GPR119CYP2C9KCNH2
SCHEMBL3255562 0.90 GPR119 (0.58) GPR119CYP2C9KCNH2
SCHEMBL386643 0.90 GPR119 (0.77) GPR119CYP2C9KCNH2
SCHEMBL3253294 0.89 GPR119 (0.61) GPR119CYP2C9KCNH2
SCHEMBL3258278 0.89 GPR119 (0.48) GPR119CYP2C9KCNH2
SCHEMBL3246517 0.88 GPR119 (0.80) GPR119CYP2C9KCNH2
SCHEMBL391626 0.87 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL3142957 0.87 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL3248519 0.86 GPR119 (0.57) 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