SCHEMBL3343199

SCHEMBL3343199

Cc1nc(S(C)(=O)=O)ccc1NC(=O)c1ccc(OC2CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.55
CYP2C9 P11712 3/20 0.48
CHEK2 O96017 1/20 0.47
CCR8 P51685 1/20 0.47
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
SCHEMBL3342840 0.89 GPR119 (0.55) GPR119CYP2C9KCNH2
SCHEMBL3343378 0.88 GPR119 (0.57) GPR119CYP2C9KCNH2
SCHEMBL3343172 0.85 GPR119 (0.55) GPR119CYP2C9
SCHEMBL3376773 0.84 GPR119 (0.54) GPR119CYP2C9KCNH2
SCHEMBL3344227 0.84 GPR119 (0.53) GPR119CYP2C9KCNH2
SCHEMBL3343133 0.84 GPR119 (0.64) GPR119CYP2C9KCNH2
SCHEMBL3342841 0.83 GPR119 (0.60) GPR119CYP2C9KCNH2
SCHEMBL3340657 0.83 GPR119 (0.60) GPR119CHEK2
SCHEMBL3342560 0.81 GPR119 (0.55) GPR119CYP2C9KCNH2
SCHEMBL3373277 0.81 GPR119 (0.48) GPR119CHEK2CCR8

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010048149-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2010-04-29 WO disclosed