SCHEMBL5132234

SCHEMBL5132234

COc1cccc(-c2cc(C3(c4ccc5c(c4)CCCO5)N=C(N)N(C)C3=O)ccc2F)c1F

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.56
BACE2 Q9Y5Z0 12/20 0.54
CTSD P07339 11/20 0.54
REN P00797 2/20 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
SCHEMBL5132684 0.96 BACE1 (0.57) BACE1BACE2CTSDREN
SCHEMBL4514009 0.90 BACE1 (0.71) BACE1BACE2CTSDREN
SCHEMBL4516455 0.86 BACE1 (0.72) BACE1BACE2CTSDREN
SCHEMBL5129942 0.85 BACE1 (0.56) BACE1BACE2CTSDREN
SCHEMBL4527068 0.83 BACE1 (0.59) BACE1BACE2CTSD
SCHEMBL5129901 0.81 BACE1 (0.61) BACE1BACE2CTSDREN
SCHEMBL8173593 0.81 BACE1 (0.65) BACE1BACE2CTSDREN
SCHEMBL8192816 0.80 BACE1 (0.51) BACE1BACE2CTSDREN
SCHEMBL4737641 0.80 BACE1 (0.56) BACE1BACE2CTSDREN
SCHEMBL5139390 0.80 BACE1 (0.55) BACE1BACE2CTSDREN

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
WO-2008076043-A1 NOVEL 2-AMINO-5,5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed
WO-2008076043-A1 NOVEL 2-AMINO-5,5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed