SCHEMBL8223587

SCHEMBL8223587

COc1ccc(C2(c3cccc(-c4cc(Cl)cc(Cl)c4)c3)N=C(N)N3CC(C)(F)CN=C32)cc1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.71
BACE2 Q9Y5Z0 5/20 0.54
CTSD P07339 5/20 0.54

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
SCHEMBL4888921 0.92 BACE1 (0.77) BACE1BACE2CTSD
SCHEMBL4881847 0.85 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL8225650 0.84 BACE1 (0.73) BACE1BACE2CTSD
SCHEMBL4887753 0.84 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL4887800 0.84 BACE1 (0.71) BACE1BACE2CTSD
SCHEMBL4884916 0.83 BACE1 (1.00) BACE1BACE2CTSD
SCHEMBL4890992 0.81 BACE1 (0.68) BACE1BACE2CTSD
SCHEMBL4892509 0.81 BACE1 (0.67) BACE1BACE2CTSD
SCHEMBL4883545 0.81 BACE1 (0.67) BACE1BACE2CTSD
SCHEMBL5103807 0.79 BACE1 (1.00) BACE1BACE2CTSD

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-2007145569-A1 AMINO-IMIDAZOLONES AND THEIR USE AS A MEDICAMENT FOR TREATING COGNITIVE IMPAIRMENT, ALZHEIMER DISEASE, NEURODEGENERATION AND DEMENTIA ASTRAZENECA AB (SE) 2007-12-21 WO disclosed