SCHEMBL17355133

SCHEMBL17355133

CC=C1c2cc(Br)ccc2CC12CCC(OC(F)F)CC2

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.47
APP P05067 4/20 0.47

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
SCHEMBL1464797 0.81 BACE1 (0.50) BACE1APP
SCHEMBL30052 0.81 BACE1 (0.50) BACE1APP
SCHEMBL1464478 0.76 BACE1 (0.42) BACE1APP
SCHEMBL7893829 0.76 BACE1 (0.42) BACE1APP
SCHEMBL1464475 0.76 BACE1 (0.42) BACE1APP
SCHEMBL16621514 0.72 BACE1 (0.47) BACE1APP
SCHEMBL16621494 0.72 BACE1 (0.47) BACE1APP
SCHEMBL30571 0.68 BACE1 (0.38) BACE1APP
SCHEMBL7892493 0.67 BACE1 (0.45) BACE1APP
SCHEMBL1466510 0.67 BACE1 (0.50) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2406240-B1 INHIBITORS OF BETA-SECRETASE VITAE PHARMACEUTICALS INC (US) 2015-12-23 EP disclosed