SCHEMBL8239934

SCHEMBL8239934

C=C(NC(Cc1cc(F)cc(F)c1)C(O)CNC1(c2nc(CC(C)(C)C)cs2)CC1)OC(C)(C)C

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.79
CTSD P07339 19/20 0.79

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
SCHEMBL14498151 0.90 BACE1 (0.84) BACE1CTSD
SCHEMBL4700639 0.88 BACE1 (1.00) BACE1CTSD
SCHEMBL4702990 0.86 BACE1 (0.87) BACE1CTSD
SCHEMBL4702996 0.86 BACE1 (0.87) BACE1CTSD
SCHEMBL4697559 0.86 BACE1 (0.87) BACE1CTSD
SCHEMBL4698668 0.82 BACE1 (0.73) BACE1CTSD
SCHEMBL8240129 0.77 BACE1 (0.78) BACE1CTSD
SCHEMBL5579116 0.76 BACE1 (0.84) BACE1CTSD
SCHEMBL8240758 0.75 BACE1 (0.84) BACE1CTSD
SCHEMBL4699445 0.74 BACE1 (1.00) BACE1CTSD

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-2007047306-A1 METHODS OF TREATING AMYLOIDOSIS USING ARYL-CYCLOPROPYL DERIVATIVE ASPARTYL PROTEASE INHIBITORS ELAN PHARMACEUTICALS, INC. (US) 2007-04-26 WO disclosed