SCHEMBL470452

SCHEMBL470452

CC(C)c1noc(N2CCC(OCc3cnc(Cl)nc3)CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 20/20 0.51
GPR183 P32249 1/20 0.42
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL458445 0.83 GPR119 (0.54) GPR119GPR183CYP3A4CYP2C19
SCHEMBL461135 0.79 GPR119 (0.61) GPR119GPR183KCNH2
SCHEMBL120996 0.77 GPR119 (0.52) GPR119GPR183KCNH2
SCHEMBL149310 0.76 GPR119 (0.48) GPR119GPR183KCNH2
SCHEMBL121152 0.76 GPR119 (0.48) GPR119GPR183KCNH2
SCHEMBL462499 0.74 GPR119 (0.53) GPR119GPR183KCNH2
SCHEMBL19059470 0.74 GPR119 (0.68) GPR119GPR183CYP3A4CYP2C19
SCHEMBL470583 0.74 GPR119 (0.47) GPR119GPR183KCNH2
SCHEMBL12474791 0.73 GPR119 (0.67) GPR119GPR183CYP3A4CYP2C19
SCHEMBL461158 0.73 GPR119 (0.50) GPR119GPR183KCNH2

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed