SCHEMBL4706955

SCHEMBL4706955

CN1C(=O)C(c2cccc(-c3cccc(F)c3)c2F)(C2CCN(C(=O)c3ccccc3)CC2)N=C1N

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.49
BACE2 Q9Y5Z0 8/20 0.49
CTSD P07339 2/20 0.42
APP P05067 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
SCHEMBL4704656 0.86 BACE1 (0.63) BACE1BACE2CTSDAPP
SCHEMBL4704875 0.83 BACE1 (0.54) BACE1BACE2CTSDAPP
SCHEMBL4706443 0.82 BACE1 (0.62) BACE1BACE2CTSDAPP
SCHEMBL4706748 0.81 BACE1 (0.56) BACE1BACE2CTSD
SCHEMBL4706837 0.80 BACE1 (0.63) BACE1BACE2CTSDAPP
SCHEMBL5146444 0.76 BACE1 (0.74) BACE1BACE2CTSDAPP
SCHEMBL4704616 0.76 BACE1 (0.62) BACE1BACE2CTSDAPP
SCHEMBL4790666 0.76 BACE1 (0.55) BACE1BACE2CTSDAPP
SCHEMBL4706336 0.75 BACE1 (0.75) BACE1BACE2CTSD
SCHEMBL4707604 0.75 BACE1 (0.75) BACE1BACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966185-A2 2-AMINO-5-PIPERIDINYLIMIDAZOLONE COMPOUNDS AND USE THEREOF FOR ß-SECRETASE MODULATION Wyeth a Corporation of the State of Delaware (US) 2008-09-10 EP disclosed
WO-2007078813-A2 2-AMINO-5-PIPERIDINYLIMIDAZOLONE COMPOUNDS AND USE THEREOF FOR β-SECRETASE MODULATION WYETH (US) 2007-07-12 WO disclosed