SCHEMBL4734010

SCHEMBL4734010

CN1C(=O)C(c2ccc3c(c2)CC(C)(C)O3)(c2ccc(F)c(-c3cccnc3)c2)N=C1N

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.66
BACE2 Q9Y5Z0 16/20 0.66
CTSD P07339 15/20 0.66
REN P00797 1/20 0.51

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
SCHEMBL8191534 0.92 BACE1 (0.64) BACE1BACE2CTSDREN
Hydrochloric Acid SCHEMBL4737259 0.91 BACE1 (0.63) BACE1BACE2CTSDREN
SCHEMBL4735526 0.91 BACE1 (0.65) BACE1BACE2CTSDREN
SCHEMBL8192259 0.86 BACE1 (0.61) BACE1BACE2CTSDREN
Hydrochloric Acid SCHEMBL4738806 0.85 BACE1 (0.65) BACE1BACE2CTSDREN
SCHEMBL4784839 0.84 BACE1 (0.70) BACE1BACE2CTSDREN
SCHEMBL4786133 0.84 BACE1 (0.73) BACE1BACE2CTSDREN
SCHEMBL4734329 0.83 BACE1 (0.66) BACE1BACE2CTSDREN
SCHEMBL4237913 0.83 BACE1 (0.79) BACE1BACE2CTSD
Hydrochloric Acid SCHEMBL4784344 0.82 BACE1 (0.51) BACE1BACE2CTSDREN

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008076044-A1 NOVEL 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO claimed
WO-2008076044-A1 NOVEL 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed