SCHEMBL1934572

SCHEMBL1934572

COC[C@H]1C[C@H]2CSC(N(C(=O)O)C(C)(C)C)=N[C@@]2(c2cc(-c3cccnc3OC)ccc2F)CO1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.46
BACE2 Q9Y5Z0 7/20 0.42
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL3301389 0.85 BACE1 (0.49) BACE1BACE2
SCHEMBL3300948 0.85 BACE1 (0.51) BACE1BACE2
SCHEMBL1934929 0.84 BACE1 (0.46) BACE1BACE2
SCHEMBL7923822 0.84 BACE1 (0.46) BACE1BACE2
SCHEMBL1935330 0.83 BACE1 (0.56) BACE1BACE2
SCHEMBL12557814 0.83 BACE1 (0.67) BACE1BACE2
SCHEMBL1935328 0.83 BACE1 (0.56) BACE1BACE2
SCHEMBL1933963 0.83 BACE1 (0.67) BACE1BACE2
SCHEMBL7914943 0.82 BACE1 (0.48) BACE1BACE2
SCHEMBL1933735 0.82 BACE1 (0.48) BACE1BACE2

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
EP-2332943-A1 NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2011-06-15 EP disclosed