SCHEMBL7124212

SCHEMBL7124212

COC(=O)C1C2CCC(N)(C(=O)OC)C21

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.50
SLC1A1 P43005 1/20 0.50
GRM8 O00222 1/20 0.49
GRM6 O15303 1/20 0.49
GRM2 Q14416 1/20 0.49
GRM3 Q14832 1/20 0.49
PPM1B O75688 1/20 0.34
PTPN1 P18031 1/20 0.34
PPP1CC P36873 1/20 0.34
SLC6A2 P23975 5/20 0.31
SLC6A4 P31645 5/20 0.31
SLC6A3 Q01959 5/20 0.31

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
SCHEMBL4810978 1.00 SLC1A2 (0.50) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL4810967 0.98 SLC1A2 (0.49) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL6697973 0.87 GRM2 (0.67) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL4810986 0.85 SLC1A2 (0.66) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL6699648 0.85 GRM2 (0.65) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL14564867 0.83 SLC1A2 (0.46) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL8354226 0.77 SLC1A2 (0.44) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL5690924 0.76 SLC1A2 (0.46) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL6469345 0.76 HSD17B10 (0.37) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL5841061 0.76 HSD17B10 (0.37) SLC1A2SLC1A1GRM8GRM6GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1310482-A1 Prodrugs of excitatory amino acids ELI LILLY AND COMPANY (US) 2003-05-14 EP disclosed
EP-0696577-B1 Synthetic excitatory amino acids LILLY CO ELI (US) 1998-10-14 EP disclosed
WO-1996005175-A1 SYNTHETIC EXCITATORY AMINO ACIDS ELI LILLY AND COMPANY (US) 1996-02-22 WO disclosed
EP-0696577-A1 Synthetic excitatory amino acids ELI LILLY AND COMPANY (US) 1996-02-14 EP disclosed