SCHEMBL4703065

SCHEMBL4703065

O=C(O)NC(Cc1cc(F)cc(F)c1)C(O)CNC1(c2cccc(N3CC4CC3CO4)c2)CC1

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.87
CTSD P07339 7/20 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
SCHEMBL4697010 0.93 BACE1 (1.00) BACE1CTSD
SCHEMBL5579132 0.90 BACE1 (0.85) BACE1CTSD
SCHEMBL5579036 0.85 BACE1 (0.66) BACE1CTSD
SCHEMBL5579034 0.84 BACE1 (0.72) BACE1CTSD
SCHEMBL5579147 0.81 BACE1 (0.77) BACE1CTSD
SCHEMBL5579143 0.81 BACE1 (0.77) BACE1CTSD
SCHEMBL4702461 0.79 BACE1 (1.00) BACE1CTSD
SCHEMBL6701309 0.78 BACE1 (0.68) BACE1CTSD
SCHEMBL6701304 0.78 BACE1 (0.68) BACE1CTSD
SCHEMBL6699533 0.78 BACE1 (0.77) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937638-A1 METHODS OF TREATING AMYLOIDOSIS USING ARYL-CYCLOPROPYL DERIVATIVE ASPARTYL PROTEASE INHIBITORS Elan Pharmaceuticals Inc. (US) 2008-07-02 EP disclosed
WO-2007047306-A1 METHODS OF TREATING AMYLOIDOSIS USING ARYL-CYCLOPROPYL DERIVATIVE ASPARTYL PROTEASE INHIBITORS ELAN PHARMACEUTICALS, INC. (US) 2007-04-26 WO disclosed