SCHEMBL7922357

SCHEMBL7922357

NC1=NC2(c3ccccc3F)COC[C@@H](F)C2CS1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.63
BACE2 Q9Y5Z0 1/20 0.46

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
SCHEMBL1935127 1.00 BACE1 (0.63) BACE1BACE2
SCHEMBL7927018 0.87 BACE1 (0.61) BACE1BACE2
SCHEMBL14716784 0.87 BACE1 (0.61) BACE1BACE2
SCHEMBL9913129 0.87 BACE1 (0.61) BACE1BACE2
SCHEMBL18124210 0.84 BACE1 (0.58) BACE1BACE2
SCHEMBL7916599 0.84 BACE1 (0.58) BACE1BACE2
SCHEMBL2931081 0.84 BACE1 (0.78) BACE1BACE2
SCHEMBL2619828 0.84 BACE1 (0.78) BACE1BACE2
SCHEMBL2622844 0.80 BACE1 (0.59) BACE1BACE2
SCHEMBL11888095 0.80 BACE1 (0.59) 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
WO-2010038686-A1 NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2010-04-08 WO disclosed