SCHEMBL6789231

SCHEMBL6789231

NC1(C(=O)O)CC(NC(=O)Nc2cccc3ccccc23)C2C(C(=O)O)C21

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 18/20 0.60
GRM3 Q14832 18/20 0.60
GRM6 O15303 3/20 0.52
GRM8 O00222 1/20 0.52
GRM4 Q14833 1/20 0.51
KDM4E B2RXH2 1/20 0.47
EPHX1 P07099 1/20 0.47

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
SCHEMBL6789050 0.85 GRM2 (0.72) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6792770 0.85 GRM2 (0.69) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6794260 0.85 GRM2 (0.63) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6796401 0.83 GRM2 (0.70) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6789006 0.83 GRM2 (0.74) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6789789 0.82 GRM2 (0.71) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6789434 0.82 GRM2 (0.61) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6794929 0.82 GRM2 (0.61) GRM2GRM3GRM6GRM8GRM4
SCHEMBL6789091 0.80 GRM2 (0.46) GRM2GRM3GRM6GRM4KDM4E
SCHEMBL6789089 0.80 GRM2 (0.46) GRM2GRM3GRM6GRM4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040116489-A1 Synthetic excitatory amino acids ELI LILLY AND COMPANY 2004-06-17 US disclosed