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Sugi Predict / Compounds / SCHEMBL3577437

SCHEMBL3577437

SCHEMBL3577437

CC(=O)N[C@@H](Cc1ccc(Cl)cc1)[C@H](O)CN[C@@H]1C[C@]2(CCOC2)Oc2ncc(CC(C)(C)C)cc21

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 20/20 0.84
▸ CTSD P07339 8/20 0.72

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
SCHEMBL3567461 1.00 BACE1 (0.84) BACE1CTSD
SCHEMBL3576172 1.00 BACE1 (0.84) BACE1CTSD
SCHEMBL3586092 1.00 BACE1 (0.84) BACE1CTSD
SCHEMBL3575537 1.00 BACE1 (0.84) BACE1CTSD
SCHEMBL3571181 1.00 BACE1 (0.84) BACE1CTSD
SCHEMBL3562172 0.93 BACE1 (0.84) BACE1CTSD
SCHEMBL3574724 0.93 BACE1 (0.84) BACE1CTSD
SCHEMBL3577948 0.93 BACE1 (0.94) BACE1CTSD
SCHEMBL3577946 0.93 BACE1 (0.94) BACE1CTSD
SCHEMBL3580211 0.91 BACE1 (0.97) 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-7745484-B2 Beta-secretase modulators and methods of use AMGEN INC. (US) 2010-06-29 — — US claimed