SCHEMBL8192259

SCHEMBL8192259

COc1cncc(-c2cc(C3(c4ccc5c(c4)CC(C)(C)O5)N=C(N)N(C)C3=O)ccc2F)c1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.61
CTSD P07339 19/20 0.55
BACE2 Q9Y5Z0 16/20 0.55
REN P00797 2/20 0.55

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
SCHEMBL4735526 0.88 BACE1 (0.65) BACE1CTSDBACE2REN
SCHEMBL4734010 0.86 BACE1 (0.66) BACE1CTSDBACE2REN
SCHEMBL4784473 0.84 BACE1 (0.61) BACE1CTSDBACE2REN
SCHEMBL4907715 0.82 BACE1 (0.73) BACE1CTSDBACE2REN
SCHEMBL8186006 0.82 BACE1 (0.54) BACE1CTSDBACE2REN
SCHEMBL4733713 0.81 BACE1 (0.49) BACE1CTSDBACE2REN
Hydrochloric Acid SCHEMBL4786576 0.81 BACE1 (0.53) BACE1CTSDBACE2REN
SCHEMBL4109494 0.81 BACE1 (0.71) BACE1CTSDBACE2REN
SCHEMBL25916161 0.81 BACE1 (0.71) BACE1CTSDBACE2REN
SCHEMBL8241101 0.79 BACE1 (0.71) BACE1CTSDBACE2REN

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-2008076044-A1 NOVEL 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed