SCHEMBL4785322

SCHEMBL4785322

CN1C(=O)C(c2ccc3c(c2)CCCO3)(c2ccc(F)c(-c3cncnc3)c2)N=C1[AsH2]

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.51
CTSD P07339 16/20 0.49
BACE2 Q9Y5Z0 16/20 0.49
REN P00797 1/20 0.49

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
SCHEMBL8173593 0.90 BACE1 (0.65) BACE1CTSDBACE2REN
SCHEMBL4737201 0.86 BACE1 (0.66) BACE1CTSDBACE2REN
Hydrochloric Acid SCHEMBL4784344 0.76 BACE1 (0.51) BACE1CTSDBACE2REN
SCHEMBL5148525 0.76 BACE1 (0.52) BACE1CTSDBACE2
SCHEMBL5139355 0.76 BACE1 (0.51) BACE1CTSDBACE2REN
SCHEMBL5129942 0.75 BACE1 (0.56) BACE1CTSDBACE2REN
SCHEMBL4735526 0.74 BACE1 (0.65) BACE1CTSDBACE2REN
SCHEMBL8192816 0.74 BACE1 (0.51) BACE1CTSDBACE2REN
SCHEMBL5139390 0.74 BACE1 (0.55) BACE1CTSDBACE2REN
SCHEMBL4737233 0.74 BACE1 (0.61) BACE1CTSDBACE2REN

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