SCHEMBL4785933

SCHEMBL4785933

CN1C(=O)C(c2cccc(Br)c2)(c2ccc3c(c2)CCOO3)NC1=S

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.38
BACE1 P56817 9/20 0.36
CTSD P07339 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
FAAH O00519 1/20 0.31

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
SCHEMBL4511507 0.90 BACE1 (0.42) CNR1BACE1CTSDBACE2
SCHEMBL4517752 0.87 CNR1 (0.38) CNR1BACE1CTSDBACE2
SCHEMBL4513812 0.83 CNR1 (0.38) CNR1BACE1FAAH
SCHEMBL4913957 0.83 CNR1 (0.44) CNR1BACE1CTSDBACE2
SCHEMBL4517959 0.82 CNR1 (0.43) CNR1BACE1FAAH
SCHEMBL4523953 0.82 CNR1 (0.43) CNR1BACE1FAAH
SCHEMBL4520613 0.79 BACE1 (0.43) CNR1BACE1CTSDBACE2FAAH
SCHEMBL4115606 0.78 CNR1 (0.51) CNR1BACE1FAAH
SCHEMBL20291002 0.78 CNR1 (0.51) CNR1BACE1FAAH
SCHEMBL4785718 0.77 CNR1 (0.46) CNR1BACE1FAAH

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