SCHEMBL3722689

SCHEMBL3722689

O=C1OC2(CCCCC2)CN1c1cccnc1F

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 13/20 0.52
KCNH2 Q12809 2/20 0.50
GRM5 P41594 5/20 0.47
TRPV4 Q9HBA0 2/20 0.39

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
SCHEMBL3032826 0.82 NPY5R (0.54) NPY5RKCNH2
SCHEMBL3041083 0.82 NPY5R (0.54) NPY5RKCNH2
SCHEMBL3032824 0.82 NPY5R (0.54) NPY5RKCNH2
Lithium Ion SCHEMBL3026578 0.81 NPY5R (0.52) NPY5RKCNH2
SCHEMBL13079376 0.77 GRM5 (0.62) NPY5RKCNH2GRM5
SCHEMBL3032395 0.77 NPY5R (0.51) NPY5RKCNH2
SCHEMBL4022146 0.76 NPY5R (0.53) NPY5RGRM5
SCHEMBL4026062 0.73 NPY5R (0.75) NPY5R
SCHEMBL4026064 0.73 NPY5R (0.75) NPY5R
SCHEMBL4023059 0.72 NPY5R (0.75) NPY5R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2139861-A1 BENZIMIDAZOLES WITH A HETERO SPIRO-DECANE RESIDUE AS NPY-Y5 ANTAGONISTS Glaxo Group Limited (GB) 2010-01-06 EP disclosed
WO-2008129007-A1 BENZIMIDAZOLES WITH A HETERO SPIRO-DECANE RESIDUE AS NPY-Y5 ANTAGONISTS GLAXO GROUP LIMITED (GB) 2008-10-30 WO disclosed