SCHEMBL5319009

SCHEMBL5319009

CC(=O)C(C)Cc1ccc(OCCCCSc2cccnc2)c(C)c1O

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 13/20 0.66
PLA2G7 Q13093 1/20 0.35

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
SCHEMBL5319146 0.88 GRM2 (0.64) GRM2
SCHEMBL5319819 0.86 GRM2 (0.64) GRM2
SCHEMBL5320205 0.85 GRM2 (0.63) GRM2
SCHEMBL5320067 0.84 GRM2 (0.61) GRM2
SCHEMBL5317630 0.83 GRM2 (0.66) GRM2
SCHEMBL5320047 0.83 GRM2 (0.46) GRM2
SCHEMBL5322180 0.80 GRM2 (0.42) GRM2
SCHEMBL4944338 0.80 GRM2 (1.00) GRM2
SCHEMBL5321096 0.79 GRM2 (0.61) GRM2
SCHEMBL5318946 0.79 GRM2 (0.44) GRM2

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-1773774-A2 HETEROCYCLIC ACETOPHENONE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS Merck & Co., Inc. (US) 2007-04-18 EP disclosed
WO-2006014918-A2 HETEROCYCLIC ACETOPHENONE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERCK & CO., INC. (US) 2006-02-09 WO disclosed