SCHEMBL4783117

SCHEMBL4783117

Cc1ccc(F)cc1-c1cccc(C2(c3cc[c]cc3)N=C(N)N(C)C2=O)c1

nearest known ligand 0.85

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.85
CTSD P07339 8/20 0.67
BACE2 Q9Y5Z0 8/20 0.67

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
SCHEMBL4926142 0.83 BACE1 (0.76) BACE1CTSDBACE2
SCHEMBL4528372 0.83 BACE1 (0.76) BACE1CTSDBACE2
SCHEMBL4783931 0.82 BACE1 (0.82) BACE1CTSDBACE2
SCHEMBL4785604 0.81 BACE1 (0.85) BACE1CTSDBACE2
SCHEMBL4785264 0.81 BACE1 (0.62) BACE1CTSDBACE2
SCHEMBL25916157 0.80 BACE1 (1.00) BACE1CTSDBACE2
SCHEMBL5136389 0.80 BACE1 (0.64) BACE1CTSDBACE2
SCHEMBL4308465 0.80 BACE1 (1.00) BACE1CTSDBACE2
SCHEMBL8238890 0.80 BACE1 (0.78) BACE1CTSDBACE2
SCHEMBL4315255 0.79 BACE1 (0.77) BACE1CTSDBACE2

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