SCHEMBL14625533

SCHEMBL14625533

NC1=NC(c2cccc(Br)c2)(c2cc(C=O)n(CCCF)c2)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.39
BACE2 Q9Y5Z0 1/20 0.39
CAMK2D Q13557 1/20 0.33
APP P05067 1/20 0.31

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
SCHEMBL14625532 0.85 BACE1 (0.41) BACE1BACE2
SCHEMBL3576060 0.84 BACE1 (0.47) BACE1BACE2APP
SCHEMBL3582643 0.79 BACE1 (0.49) BACE1BACE2APP
SCHEMBL14625450 0.73 BACE1 (0.39) BACE1BACE2APP
SCHEMBL8379823 0.72 BACE1 (0.62) BACE1BACE2
SCHEMBL3573563 0.72 BACE1 (0.48) BACE1BACE2APP
SCHEMBL14625534 0.71 BACE1 (0.48) BACE1BACE2APP
SCHEMBL3575846 0.70 BACE1 (0.53) BACE1BACE2APP
SCHEMBL14625775 0.70 BACE1 (0.46) BACE1BACE2APP
SCHEMBL14625773 0.69 BACE1 (0.50) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007005366-A1 AMlNO-5-(5-MEMBERED)HETEROARYLIMIDAZOLONE COMPOUNDS AND THE USE THEREOF FOR β-SECRETASE MODULATION WYETH (US) 2007-01-11 WO disclosed