SCHEMBL8225650

SCHEMBL8225650

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

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 18/20 0.73
CTSD P07339 7/20 0.55
BACE2 Q9Y5Z0 6/20 0.55
KCNH2 Q12809 1/20 0.45
CTSE P14091 1/20 0.45

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
SCHEMBL4887800 0.90 BACE1 (0.71) BACE1CTSDBACE2KCNH2CTSE
SCHEMBL4887753 0.90 BACE1 (0.71) BACE1CTSDBACE2KCNH2CTSE
SCHEMBL4881847 0.90 BACE1 (0.71) BACE1CTSDBACE2KCNH2CTSE
SCHEMBL4890992 0.88 BACE1 (0.68) BACE1CTSDBACE2KCNH2CTSE
SCHEMBL4892509 0.87 BACE1 (0.67) BACE1CTSDBACE2KCNH2CTSE
SCHEMBL4883545 0.87 BACE1 (0.67) BACE1CTSDBACE2CTSE
SCHEMBL4888095 0.85 BACE1 (0.64) BACE1CTSDBACE2KCNH2CTSE
SCHEMBL4890667 0.85 BACE1 (0.64) BACE1CTSDBACE2KCNH2CTSE
SCHEMBL8223587 0.84 BACE1 (0.71) BACE1CTSDBACE2
SCHEMBL4884916 0.84 BACE1 (1.00) BACE1CTSDBACE2

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