SCHEMBL8325221

SCHEMBL8325221

CCCN(CCC)C(=O)c1cc(C)cc(C(=O)NC(Cc2cc(F)cc(F)c2)C(O)CCNC(=O)CCOC)c1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.61
BACE2 Q9Y5Z0 6/20 0.61
CTSD P07339 2/20 0.58
CTSE P14091 1/20 0.56

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
SCHEMBL5454588 1.00 BACE1 (0.61) BACE1BACE2CTSDCTSE
SCHEMBL5367907 0.93 BACE1 (0.65) BACE1BACE2CTSDCTSE
SCHEMBL5367912 0.93 BACE1 (0.65) BACE1BACE2CTSDCTSE
SCHEMBL5374149 0.93 BACE1 (0.65) BACE1BACE2CTSDCTSE
SCHEMBL5374102 0.93 BACE1 (0.62) BACE1BACE2CTSDCTSE
SCHEMBL5372778 0.92 BACE1 (0.63) BACE1BACE2CTSDCTSE
SCHEMBL5367440 0.92 BACE1 (0.63) BACE1BACE2CTSDCTSE
SCHEMBL5372764 0.91 BACE1 (0.59) BACE1BACE2CTSDCTSE
SCHEMBL5365649 0.91 BACE1 (0.64) BACE1BACE2CTSDCTSE
SCHEMBL5369546 0.91 BACE1 (0.67) BACE1BACE2CTSD

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
US-7262208-B2 Hydroxypropyl amides for the treatment of Alzheimer's disease ELAN PHARMACEUTICALS, INC. (US) 2007-08-28 US disclosed
US-7262208-B2 Hydroxypropyl amides for the treatment of Alzheimer's disease ELAN PHARMACEUTICALS, INC. (US) 2007-08-28 US disclosed
WO-2004058686-A1 HYDROXYPROPYL AMIDES FOR THE TREATMENT OF ALZHEIMER’S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2004-07-15 WO disclosed