SCHEMBL5846784

SCHEMBL5846784

CS(=O)(=O)c1ccc(-n2ncc3c(OC4CCNC(c5ccc(Br)cn5)C4)ncnc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.55
CYP2C9 P11712 1/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL390767 0.82 GPR119 (0.68) GPR119CYP2C9KCNH2
Hydrochloric Acid SCHEMBL1244784 0.81 GPR119 (0.67) GPR119CYP2C9KCNH2
SCHEMBL391186 0.80 GPR119 (0.64) GPR119CYP2C9KCNH2
SCHEMBL1245728 0.78 GPR119 (0.65) GPR119CYP2C9KCNH2
SCHEMBL28776749 0.75 GPR119 (0.48) GPR119
SCHEMBL27769080 0.74 GPR119 (0.66) GPR119CYP2C9KCNH2
SCHEMBL288589 0.73 GPR119 (0.80) GPR119CYP2C9KCNH2
SCHEMBL1071062 0.72 GPR119 (0.75) GPR119CYP2C9KCNH2
SCHEMBL389488 0.71 GPR119 (0.70) GPR119CYP2C9KCNH2
SCHEMBL12835587 0.71 GPR119 (0.54) 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
US-7132426-B2 Fused-aryl and heteroaryl derivatives as modulators of metabolism and the prophylaxis and treatment of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2006-11-07 US claimed