SCHEMBL28389656

SCHEMBL28389656

NC(CCC(=O)O)C(=O)OCc1ccccc1.NC(CCC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 3/20 0.49
SLC1A3 P43003 2/20 0.49
GRM8 O00222 1/20 0.49
GRM6 O15303 1/20 0.49
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GSR P00390 1/20 0.49
CYP1A2 P05177 1/20 0.49
GRIK1 P39086 1/20 0.49
GRM5 P41594 1/20 0.49
GRIA1 P42261 1/20 0.49
GRIA2 P42262 1/20 0.49
GRIA3 P42263 1/20 0.49
SLC1A2 P43004 1/20 0.49
GRIA4 P48058 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIK2 Q13002 1/20 0.49
GRIK3 Q13003 1/20 0.49
GRIN2B Q13224 1/20 0.49

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
Glutamic Acid SCHEMBL28192477 1.00 SLC1A1 (0.49) SLC1A1SLC1A3GRM8GRM6GRIN2D
Glutamic Acid SCHEMBL7243656 0.96 SLC1A1 (0.53) SLC1A1SLC1A3GRM8GRM6GRIN2D
SCHEMBL1918223 0.92 ALDH1A1 (0.54) SLC1A1SLC1A3LTA4HSLC15A1ALDH1A1
SCHEMBL432780 0.92 SLC15A1 (0.55) SLC1A1SLC1A3CYP1A2SLC1A2LTA4H
SCHEMBL4850398 0.92 SLC15A1 (0.55) SLC1A1SLC1A3CYP1A2SLC1A2LTA4H
SCHEMBL124384 0.92 ALDH1A1 (0.54) SLC1A1SLC1A3LTA4HSLC15A1ALDH1A1
SCHEMBL124385 0.92 SLC15A1 (0.55) SLC1A1SLC1A3CYP1A2SLC1A2LTA4H
SCHEMBL124386 0.92 ALDH1A1 (0.54) SLC1A1SLC1A3LTA4HSLC15A1ALDH1A1
Hydrochloric Acid SCHEMBL5274239 0.90 ALDH1A1 (0.53) SLC1A1SLC1A3LTA4HSLC15A1ALDH1A1
Hydrochloric Acid SCHEMBL19839422 0.90 ALDH1A1 (0.53) SLC1A1SLC1A3LTA4HSLC15A1ALDH1A1

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-111087613-B Activity-controllable anticoagulant degradable high polymer material and synthesis method thereof 西北师范大学 2022-06-14 CN disclosed
CN-111087613-A Activity-controllable anticoagulant degradable high polymer material and synthesis method thereof 西北师范大学 2020-05-01 CN disclosed