SCHEMBL15717545

SCHEMBL15717545

NC1=NCC[C@]2(S1)c1cc(N)ccc1Oc1cnc(Cl)cc12

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 7/20 0.42
CTSD P07339 2/20 0.37

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
SCHEMBL2370875 0.90 BACE1 (0.53) BACE1CTSD
SCHEMBL15717058 0.90 BACE1 (0.53) BACE1CTSD
SCHEMBL15716789 0.84 BACE1 (0.38) BACE1CTSD
SCHEMBL15717105 0.81 BACE1 (0.41) BACE1CTSD
SCHEMBL14808434 0.80 BACE1 (0.42) BACE1CTSD
SCHEMBL15717046 0.80 BACE1 (0.42) BACE1CTSD
SCHEMBL15717111 0.75 BACE1 (0.49) BACE1CTSD
SCHEMBL15717110 0.75 BACE1 (0.49) BACE1CTSD
SCHEMBL14808172 0.73 BACE1 (0.37) BACE1
SCHEMBL16109784 0.72 BACE1 (0.65) 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
WO-2014078314-A1 AMINO-OXAZINE AND AMINO-DIHYDROTHIAZINE COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2014-05-22 WO disclosed