SCHEMBL1244945

SCHEMBL1244945

Cn1cccc1C(=O)N1CCC(Oc2ccnc3c2cnn3-c2ccc(S(C)(=O)=O)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.53
PDE4B Q07343 1/20 0.42
CYP2C9 P11712 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL389101 0.88 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL1245445 0.79 GPR119 (0.53) GPR119CYP2C9KCNH2
SCHEMBL389403 0.75 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL391674 0.73 GPR119 (0.72) GPR119CYP2C9KCNH2
SCHEMBL389698 0.73 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL389080 0.73 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL390642 0.73 GPR119 (0.72) GPR119CYP2C9KCNH2
SCHEMBL13404782 0.73 GPR119 (0.71) GPR119CYP2C9KCNH2
SCHEMBL390160 0.73 GPR119 (0.69) GPR119CYP2C9KCNH2
SCHEMBL389429 0.73 GPR119 (0.69) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2287165-A2 Fused-aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto Arena Pharmaceuticals, Inc. (US) 2011-02-23 EP disclosed