SCHEMBL4848219

SCHEMBL4848219

CCCS(=O)(=O)Oc1ccc(C2(c3cccc(-c4ccc(F)c(OC)c4)c3)NC(N)N(C)C2=O)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.35
CA2 P00918 2/20 0.35
BACE1 P56817 13/20 0.33
CTSD P07339 7/20 0.33
BACE2 Q9Y5Z0 7/20 0.33
REN P00797 1/20 0.31
PARP1 P09874 1/20 0.30
PARP2 Q9UGN5 1/20 0.30
JAK1 P23458 1/20 0.30

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
SCHEMBL5134703 0.82 FFAR1 (0.36) BACE1CTSDBACE2
SCHEMBL4517007 0.78 BACE1 (0.60) BACE1CTSDBACE2
SCHEMBL4787010 0.76 BACE1 (0.36) BACE1CTSDBACE2
SCHEMBL4520929 0.73 BACE1 (0.59) BACE1CTSDBACE2REN
SCHEMBL5134308 0.72 BACE1 (0.43) BACE1CTSDBACE2
SCHEMBL5135553 0.71 BACE1 (0.42) BACE1CTSDBACE2
SCHEMBL4884929 0.71 BACE1 (0.60) BACE1CTSDBACE2REN
Hydrochloric Acid SCHEMBL5137186 0.70 BACE1 (0.38) BACE1CTSDBACE2
SCHEMBL4511003 0.69 BACE1 (0.57) BACE1CTSDBACE2REN
SCHEMBL4525769 0.69 BACE1 (0.35) BACE1

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