SCHEMBL991135

SCHEMBL991135

CN1C(=O)[C@@H]2[C@@H](C(F)(F)F)OC[C@]2(c2cc(N)ccc2F)N=C1N(C(=O)ON)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.38
BACE2 Q9Y5Z0 19/20 0.38

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
Ammonia Solution, Strong SCHEMBL991134 0.90 BACE1 (0.39) BACE1BACE2
SCHEMBL8514734 0.83 BACE1 (0.39) BACE1BACE2
SCHEMBL991283 0.83 BACE1 (0.42) BACE1BACE2
SCHEMBL989874 0.81 BACE1 (0.34) BACE1BACE2
SCHEMBL6920107 0.80 BACE1 (0.38) BACE1BACE2
SCHEMBL11901104 0.78 BACE1 (0.41) BACE1BACE2
SCHEMBL6922277 0.78 BACE1 (0.41) BACE1BACE2
Ammonia Solution, Strong SCHEMBL8514730 0.78 BACE1 (0.40) BACE1BACE2
SCHEMBL11900700 0.76 BACE1 (0.40) BACE1BACE2
SCHEMBL6920051 0.74 BACE1 (0.37) 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-2011009897-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD (JP) 2011-01-27 WO disclosed