SCHEMBL8532802

SCHEMBL8532802

CCCOC(=O)C1C2CCC(N)(C(=O)OCCC)C21

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
GRM8 O00222 1/20 0.43
GRM6 O15303 1/20 0.43
GRM2 Q14416 1/20 0.43
GRM3 Q14832 1/20 0.43
PPM1B O75688 1/20 0.41
PTPN1 P18031 1/20 0.41
PPP1CC P36873 1/20 0.41
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL8530212 0.92 SLC1A2 (0.42) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL8533271 0.89 SLC1A2 (0.40) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL6703583 0.85 GRM8 (0.41) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL5690924 0.85 SLC1A2 (0.46) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL8354778 0.81 SLC1A2 (0.43) SLC1A2SLC1A1GRM8GRM6GRM2
Hydrochloric Acid SCHEMBL6702822 0.81 SLC1A2 (0.38) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL8358720 0.77 SLC1A2 (0.44) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL8354226 0.77 SLC1A2 (0.44) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL7124212 0.74 SLC1A2 (0.50) SLC1A2SLC1A1GRM8GRM6GRM2
SCHEMBL4810978 0.74 SLC1A2 (0.50) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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