SCHEMBL1384484

SCHEMBL1384484

COC(Cc1ccc2c(N)ncnc2c1)N1CCN(S(=O)(=O)Nc2ccc(Cl)cc2)CC1=O

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.45
AKT1 P31749 4/20 0.34
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
SCN9A Q15858 1/20 0.32
ACHE P22303 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL7146953 0.85 F10 (0.44) F10AKT1
SCHEMBL7146946 0.85 F10 (0.44) F10AKT1
SCHEMBL4387290 0.77 F10 (0.39) F10AKT1
SCHEMBL4387303 0.77 F10 (0.39) F10AKT1
SCHEMBL1387133 0.76 PDGFRB (0.42)
SCHEMBL1652127 0.76 PDGFRB (0.47) F10
SCHEMBL1386717 0.73 F10 (0.38) F10AKT1
SCHEMBL1652705 0.73 F10 (0.37) F10AKT1
SCHEMBL1652300 0.73 PDGFRB (0.47) F10AKT1
SCHEMBL1654617 0.72 F10 (0.64) F10

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
JP-4829449-B2 2011-12-07 JP claimed