SCHEMBL2370942

SCHEMBL2370942

CC(C)(C)N(C(=O)O)C1=NCCC2(S1)c1cc(I)ccc1Oc1ncc(Br)cc12

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.33

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
SCHEMBL2523497 0.82 BACE1 (0.39) BACE1
SCHEMBL14629846 0.81 BACE1 (0.37) BACE1
SCHEMBL2370933 0.80 BACE1 (0.35) BACE1
SCHEMBL2370552 0.72 MAPT (0.39) BACE1
SCHEMBL2371927 0.69 BACE1 (0.35) BACE1
SCHEMBL14807845 0.68 BACE1 (0.37) BACE1
SCHEMBL2370435 0.68 BACE1 (0.37) BACE1
SCHEMBL2370748 0.68 BACE1 (0.37) BACE1
SCHEMBL2371084 0.68 BACE1 (0.37) BACE1
SCHEMBL14808102 0.68 BACE1 (0.37) BACE1

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-2011115928-A1 AMINO -DIHYDROOXAZINE AND AMINO - DIHYDROTHIAZINE SPIRO COMPOUNDS AS BETA - SECRETASE MODULATORS AND THEIR MEDICAL USE AMGEN INC. (US) 2011-09-22 WO disclosed