SCHEMBL27665779

SCHEMBL27665779

CCC(CC(N)C(=O)O)C(C)c1cc(C)c(C)c(C)c1C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 9/20 0.39
SLC1A3 P43003 8/20 0.39
SLC1A1 P43005 8/20 0.39
SLC7A5 Q01650 1/20 0.39
GRIK1 P39086 4/20 0.34
GRIK2 Q13002 4/20 0.34
THRA P10827 2/20 0.33
THRB P10828 2/20 0.33
GRM1 Q13255 1/20 0.33
KIF11 P52732 1/20 0.32

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
SCHEMBL27644271 0.88 SLC1A3 (0.38) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27644301 0.86 SLC1A3 (0.39) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27665798 0.83 SLC1A2 (0.39) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27643941 0.83 SLC1A2 (0.41) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27665292 0.80 ALDH1A1 (0.40) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27644008 0.80 SLC1A3 (0.38) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27643954 0.80 GRIK1 (0.39) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL28761472 0.79 SLC1A3 (0.41) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27644197 0.77 SLC1A2 (0.41) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1
SCHEMBL27644795 0.76 SLC1A3 (0.40) SLC1A2SLC1A3SLC1A1SLC7A5GRIK1

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
CN-1886363-A Amino acids with affinity for the alpha2delta-protein WARNER LAMBERT CO (US) 2006-12-27 CN claimed
CN-1886363-A Amino acids with affinity for the alpha2delta-protein WARNER LAMBERT CO (US) 2006-12-27 CN disclosed