SCHEMBL8973469

SCHEMBL8973469

NC1(C(=O)O)CC(C(=O)O)N(CCc2ccccc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 7/20 1.00
GRM6 O15303 1/20 0.76
GRM3 Q14832 4/20 0.64
GRM5 P41594 1/20 0.56

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
SCHEMBL8972917 1.00 GRM2 (1.00) GRM2GRM6GRM3GRM5
SCHEMBL8973322 0.92 GRM2 (0.85) GRM2GRM6GRM3GRM5
SCHEMBL8972938 0.91 GRM2 (0.83) GRM2GRM6GRM3GRM5
SCHEMBL8973271 0.90 GRM2 (0.81) GRM2GRM6GRM3GRM5
SCHEMBL8973264 0.86 GRM6 (1.00) GRM2GRM6GRM3GRM5
SCHEMBL8061968 0.86 GRM6 (1.00) GRM2GRM6GRM3GRM5
SCHEMBL8973013 0.80 GRM6 (0.87) GRM2GRM6GRM3GRM5
SCHEMBL8973200 0.79 GRM2 (0.65) GRM2GRM6GRM3
SCHEMBL5566282 0.79 GRM6 (0.75) GRM2GRM6GRM3GRM5
SCHEMBL8972526 0.78 GRM2 (1.00) GRM2GRM6GRM3

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-0703218-A1 Pyrrolidinyl di-carboxylic acid derivatives as metabotropic glutamate receptor antagonists ELI LILLY AND COMPANY (US) 1996-03-27 EP disclosed
WO-1996005828-A1 PYRROLIDINYL DI-CARBOXYLIC ACID DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-02-29 WO disclosed