SCHEMBL3258269

SCHEMBL3258269

COc1c(Nc2ccc(NCC(O)CO)nc2C)ncnc1OC1CCN(OC(=O)OC(C)C)CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.56
CYP2C9 P11712 3/20 0.56
KCNH2 Q12809 1/20 0.56
ACACB O00763 1/20 0.35

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
SCHEMBL3257118 0.94 GPR119 (0.58) GPR119CYP2C9KCNH2ACACB
SCHEMBL3151965 0.90 GPR119 (0.69) GPR119CYP2C9KCNH2
SCHEMBL387171 0.90 GPR119 (0.69) GPR119CYP2C9KCNH2
SCHEMBL3257114 0.90 GPR119 (0.61) GPR119CYP2C9KCNH2
SCHEMBL3254373 0.89 GPR119 (0.57) GPR119CYP2C9KCNH2ACACB
SCHEMBL5817927 0.87 GPR119 (0.56) GPR119CYP2C9KCNH2
SCHEMBL3253085 0.85 GPR119 (0.59) GPR119CYP2C9KCNH2ACACB
SCHEMBL3254299 0.84 GPR119 (0.58) GPR119CYP2C9KCNH2ACACB
SCHEMBL3253613 0.83 GPR119 (0.58) GPR119CYP2C9KCNH2ACACB
SCHEMBL3255562 0.83 GPR119 (0.58) GPR119CYP2C9KCNH2ACACB

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