SCHEMBL13639864

SCHEMBL13639864

CC(C)(C)[Si](C)(C)OCCC[C@@H](C[C@H](N)C(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 6/20 0.55
SLC1A2 P43004 6/20 0.55
SLC1A3 P43003 4/20 0.55
GRIK1 P39086 4/20 0.54
GRIK2 Q13002 3/20 0.54
GRM2 Q14416 1/20 0.44
GRM3 Q14832 1/20 0.44

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
SCHEMBL28580283 0.88 GSR (0.43)
SCHEMBL191235 0.84 NOS3 (0.41) SLC1A1SLC1A2SLC1A3GRIK1GRIK2
SCHEMBL490891 0.84 NOS3 (0.41) SLC1A1SLC1A2SLC1A3GRIK1GRIK2
SCHEMBL191236 0.84 NOS3 (0.41) SLC1A1SLC1A2SLC1A3GRIK1GRIK2
SCHEMBL18019367 0.80 SLC1A2 (0.33) SLC1A1SLC1A2SLC1A3GRIK1GRIK2
SCHEMBL16798436 0.77 SLC1A2 (0.40) SLC1A1SLC1A2SLC1A3GRIK1GRIK2
SCHEMBL9989984 0.76 GPR84 (0.43)
SCHEMBL9989980 0.76 GPR84 (0.43)
SCHEMBL10314812 0.74 NOS3 (0.38) SLC1A1SLC1A2SLC1A3GRIK1GRIK2
SCHEMBL20591675 0.74 NOS3 (0.38) SLC1A1SLC1A2SLC1A3GRIK1GRIK2

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
WO-2012150204-A1 NOVEL PRECURSORS OF GLUTAMATE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-11-08 WO disclosed
EP-2520557-A1 Novel precursors of glutamate derivatives Bayer Pharma Aktiengesellschaft (DE) 2012-11-07 EP disclosed