SCHEMBL4785590

SCHEMBL4785590

CN1C(=O)C(c2ccc(F)c(Br)c2)(c2ccc3c(c2)OC(F)(F)O3)NC1=S

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.38
BACE1 P56817 2/20 0.35
PDE2A O00408 1/20 0.32
FAAH O00519 1/20 0.31
CFTR P13569 1/20 0.31
NOTUM Q6P988 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CG P48736 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
SCHEMBL4786160 0.94 CNR1 (0.38) CNR1BACE1FAAH
SCHEMBL4732724 0.82 CNR1 (0.47) CNR1FAAH
SCHEMBL4734518 0.82 CNR1 (0.35) CNR1BACE1
SCHEMBL4520943 0.81 CNR1 (0.44) CNR1FAAH
SCHEMBL4740565 0.81 BACE1 (0.36) CNR1BACE1
SCHEMBL4738661 0.80 PKM (0.38) CNR1BACE1
SCHEMBL4740558 0.80 CNR1 (0.35) CNR1BACE1NOTUM
SCHEMBL4737236 0.78 CNR1 (0.39) CNR1BACE1FAAH
SCHEMBL4738306 0.77 CNR1 (0.41) CNR1BACE1FAAH
SCHEMBL4737591 0.77 BACE1 (0.39) 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-2008076044-A1 NOVEL 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed