SCHEMBL6311520

SCHEMBL6311520

Cc1cccc(C#Cc2nccs2)c1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.65
HAO1 Q9UJM8 1/20 0.46
ALOX5 P09917 1/20 0.43
FFAR1 O14842 2/20 0.41
ACACB O00763 1/20 0.41
SRC P12931 1/20 0.40
CDK2 P24941 1/20 0.40
ZAP70 P43403 1/20 0.40
SYK P43405 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
PDE10A Q9Y233 1/20 0.40

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
SCHEMBL9094185 0.81 GRM5 (0.65) GRM5HAO1FFAR1ACACBPDE10A
SCHEMBL30278513 0.80 GRM5 (0.68) GRM5HAO1ALOX5ACACBPDE10A
SCHEMBL6311975 0.79 GRM5 (1.00) GRM5HAO1ACACBPDE10A
SCHEMBL30469481 0.76 GRM5 (0.69) GRM5FFAR1
SCHEMBL30469478 0.76 GRM5 (0.69) GRM5FFAR1
SCHEMBL4562089 0.76 GRM5 (0.69) GRM5FFAR1
SCHEMBL9094022 0.76 GRM5 (0.62) GRM5HAO1ACACB
SCHEMBL9092851 0.75 GRM5 (0.56) GRM5HAO1FFAR1
SCHEMBL15870993 0.74 GRM5 (0.68) GRM5HAO1ACACBPDE10A
SCHEMBL30278486 0.74 GRM5 (0.55) GRM5HAO1FFAR1SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6956049-B1 Methods of modulating processes mediated by excitatory amino acid receptors MERCK & CO., INC. (US) 2005-10-18 US disclosed
EP-1214303-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF Merck & Co., Inc. (US) 2002-06-19 EP disclosed
WO-2001016121-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF MERCK & CO., INC. (US) 2001-03-08 WO disclosed