SCHEMBL6895248

SCHEMBL6895248

O=C(O)NC(Cc1ccccc1)C(O)CNCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 12/20 0.56
SLC6A11 P48066 1/20 0.56
PLA2G1B P04054 1/20 0.55
POLB P06746 1/20 0.55
ATG4B Q9Y4P1 1/20 0.55
BCHE P06276 8/20 0.54
CTSD P07339 3/20 0.49

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
SCHEMBL7607375 1.00 BACE1 (0.56) BACE1SLC6A11PLA2G1BPOLBATG4B
SCHEMBL7607369 1.00 BACE1 (0.56) BACE1SLC6A11PLA2G1BPOLBATG4B
SCHEMBL7607624 0.87 BACE1 (0.58) BACE1SLC6A11BCHECTSD
SCHEMBL7607629 0.87 BACE1 (0.58) BACE1SLC6A11BCHECTSD
SCHEMBL6894836 0.87 BACE1 (0.58) BACE1SLC6A11BCHECTSD
SCHEMBL7614224 0.86 BACE1 (0.62) BACE1SLC6A11BCHE
SCHEMBL7614214 0.86 BACE1 (0.62) BACE1SLC6A11BCHE
SCHEMBL7610032 0.86 BACE1 (0.71) BACE1SLC6A11BCHE
SCHEMBL7610027 0.86 BACE1 (0.71) BACE1SLC6A11BCHE
SCHEMBL6896189 0.85 BACE1 (0.58) BACE1SLC6A11BCHECTSD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004502669-A 2004-01-29 JP claimed
EP-1353898-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2003-10-22 EP claimed
WO-2002002512-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed