SCHEMBL16622124

SCHEMBL16622124

COC1CCC2(CC1)Cc1ccc(OCC3CC(F)(F)C3)cc1C2=O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.54
APP P05067 1/20 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
SCHEMBL7887738 0.90 BACE1 (0.52) BACE1APP
SCHEMBL9948474 0.88 BACE1 (0.52) BACE1APP
SCHEMBL9948476 0.88 BACE1 (0.52) BACE1APP
SCHEMBL16622125 0.87 BACE1 (0.40) BACE1APP
SCHEMBL16622126 0.86 BACE1 (0.39) BACE1APP
SCHEMBL9948077 0.82 BACE1 (0.52) BACE1APP
SCHEMBL9948076 0.82 BACE1 (0.52) BACE1APP
SCHEMBL9948154 0.81 BACE1 (0.52) BACE1APP
SCHEMBL12746365 0.81 BACE1 (0.52) BACE1APP
SCHEMBL7893775 0.80 BACE1 (0.47) BACE1APP

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
US-9000185-B2 Cycloalkyl ether compounds and their use as BACE inhibitors ASTRAZENECA AB (SE) 2015-04-07 US disclosed
US-9000185-B2 Cycloalkyl ether compounds and their use as BACE inhibitors ASTRAZENECA AB (SE) 2015-04-07 US disclosed