SCHEMBL4898408

SCHEMBL4898408

CN1C(=O)C(c2ccc(OS(=O)(=O)C3CC3)cc2)(c2cccc(-c3cncnc3)c2)N=C1N

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.68
BACE2 Q9Y5Z0 15/20 0.62
CTSD P07339 9/20 0.62
REN P00797 1/20 0.61

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
SCHEMBL4511168 0.94 BACE1 (0.64) BACE1BACE2CTSDREN
SCHEMBL4518549 0.86 BACE1 (0.67) BACE1BACE2CTSDREN
SCHEMBL4527450 0.84 BACE1 (0.68) BACE1BACE2CTSDREN
SCHEMBL4524188 0.84 BACE1 (0.66) BACE1BACE2CTSDREN
SCHEMBL4518593 0.83 BACE1 (0.66) BACE1BACE2CTSDREN
SCHEMBL4240351 0.82 BACE1 (0.81) BACE1BACE2CTSD
SCHEMBL4513803 0.82 BACE1 (0.67) BACE1BACE2CTSDREN
SCHEMBL23190467 0.81 BACE1 (0.76) BACE1BACE2CTSDREN
SCHEMBL20814013 0.81 BACE1 (1.00) BACE1BACE2CTSDREN
SCHEMBL4523967 0.80 BACE1 (0.53) BACE1BACE2CTSD

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-2008076046-A1 NOVEL 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed