SCHEMBL5515980

SCHEMBL5515980

CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@@H](O)CNC1(c2cccc(C3CCCC3)c2)CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 1.00
CTSD P07339 6/20 0.82

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
SCHEMBL5668730 1.00 BACE1 (1.00) BACE1CTSD
SCHEMBL3171136 1.00 BACE1 (1.00) BACE1CTSD
SCHEMBL5670368 1.00 BACE1 (1.00) BACE1CTSD
SCHEMBL5669151 0.98 BACE1 (0.97) BACE1CTSD
SCHEMBL4698046 0.97 BACE1 (0.95) BACE1CTSD
SCHEMBL5668603 0.97 BACE1 (0.95) BACE1CTSD
SCHEMBL3177906 0.97 BACE1 (0.93) BACE1CTSD
SCHEMBL4701598 0.97 BACE1 (0.93) BACE1CTSD
SCHEMBL5507118 0.97 BACE1 (0.93) BACE1CTSD
SCHEMBL8283821 0.90 BACE1 (0.82) 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
US-7244725-B2 Acetyl 2-hydroxy-1, 3-diaminoalkanes ELAN PHARMACEUTICALS, INC. (US) 2007-07-17 US disclosed