SCHEMBL3254121

SCHEMBL3254121

CCC(C)OC(=O)ON1CCC(Oc2ccnc(Nc3ccc(S(=O)(=O)CC)cc3F)c2OC)CC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.42
GPR6 P46095 4/20 0.36
CYP2C9 P11712 1/20 0.36
KCNH2 Q12809 1/20 0.36
EGFR P00533 3/20 0.36
ERBB2 P04626 3/20 0.36
FGFR1 P11362 1/20 0.34
FLT1 P17948 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL389581 0.90 GPR119 (0.52) GPR119CYP2C9KCNH2EGFR
SCHEMBL3254476 0.89 GPR119 (0.45) GPR119GPR6CYP2C9KCNH2ERBB2
SCHEMBL14458861 0.86 GPR119 (0.58) GPR119CYP2C9KCNH2
SCHEMBL5822810 0.85 GPR119 (0.45) GPR119GPR6CYP2C9KCNH2EGFR
SCHEMBL3253994 0.82 ACACB (0.42) GPR119EGFRERBB2
SCHEMBL3252589 0.81 GPR119 (0.41) GPR119GPR6CYP2C9KCNH2EGFR
SCHEMBL3252680 0.81 GPR119 (0.39) GPR119GPR6CYP2C9KCNH2EGFR
SCHEMBL5050891 0.80 FLT1 (0.38) GPR119EGFRFGFR1FLT1KDR
SCHEMBL3252644 0.80 ACACB (0.39) GPR119GPR6CYP2C9KCNH2ERBB2
SCHEMBL3252397 0.80 GPR6 (0.45) GPR119GPR6

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