SCHEMBL5200652

SCHEMBL5200652

O=CCc1ccc(OCc2ccc(Oc3cccc(-c4nn[nH]n4)c3)cc2)c(C(F)(F)F)c1O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 14/20 0.59
CYSLTR1 Q9Y271 14/20 0.59
MRGPRX4 Q96LA9 3/20 0.45
SLC22A12 Q96S37 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.38

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
SCHEMBL5201154 0.86 GRM2 (0.75) GRM2CYSLTR1MRGPRX4CYSLTR2
SCHEMBL481322 0.85 CYSLTR1 (0.79) GRM2CYSLTR1MRGPRX4CYSLTR2
SCHEMBL27856742 0.83 CYSLTR1 (0.61) GRM2CYSLTR1MRGPRX4CYSLTR2
SCHEMBL5200758 0.75 CYSLTR1 (0.44) GRM2CYSLTR1MRGPRX4CYSLTR2
SCHEMBL5202571 0.74 CYSLTR1 (0.48) GRM2CYSLTR1MRGPRX4CYSLTR2
SCHEMBL5200694 0.73 GRM2 (0.53) GRM2CYSLTR1
SCHEMBL481031 0.73 CYSLTR1 (0.70) GRM2CYSLTR1MRGPRX4CYSLTR2
SCHEMBL6246211 0.73 GRM2 (0.54) GRM2CYSLTR1SLC22A12CYSLTR2
SCHEMBL5199133 0.73 CYSLTR1 (0.43) GRM2CYSLTR1MRGPRX4CYSLTR2
SCHEMBL27686230 0.71 CYSLTR1 (0.53) GRM2CYSLTR1MRGPRX4CYSLTR2

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-1817301-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2007-08-15 EP disclosed
WO-2006057870-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2006-06-01 WO disclosed