SCHEMBL4516176

SCHEMBL4516176

NC(CC(=O)C=O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 13/20 0.50
▸ GRIK2 Q13002 8/20 0.50
▸ GRM1 Q13255 1/20 0.48
▸ GRM2 Q14416 1/20 0.48
▸ SLC7A5 Q01650 1/20 0.46
▸ GRIA4 P48058 3/20 0.45
▸ GRIK3 Q13003 3/20 0.45
▸ GRIK5 Q16478 3/20 0.45
▸ GRIA2 P42262 2/20 0.45
▸ GRIA1 P42261 1/20 0.45
▸ PTGS1 P23219 1/20 0.44
▸ SLC7A11 Q9UPY5 1/20 0.44
▸ SLC1A1 P43005 3/20 0.43
▸ GGT1 P19440 2/20 0.43
▸ SLC1A3 P43003 2/20 0.41
▸ SLC1A2 P43004 2/20 0.41

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
Aspartic Acid SCHEMBL21494996 0.78 GRIK1 (0.48) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL27866701 0.75 GRIK1 (0.50) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL7044236 0.75 GRIK1 (0.50) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL7768957 0.75 GRIK1 (0.50) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL3230 0.73 — —
D-Aspartate SCHEMBL145539 0.73 — —
Aspartic Acid SCHEMBL996424 0.73 GRIK1 (0.56) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL11065189 0.73 GRIK1 (0.56) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL1526976 0.73 GRIK1 (0.56) GRIK1GRIK2GRM1GRM2SLC7A5
Aspartic Acid SCHEMBL3231 0.73 — —

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-3013964-B1 COMPOSITIONS FOR INTRODUCING RNA INTO CELLS ETHRIS GMBH (DE) 2020-05-06 — — EP disclosed
US-7626022-B2 Racemic mixtures; oxidation; cyclization; crystallization CHIRACON GMBH (DE) 2009-12-01 — — US disclosed
US-20050080263-A1 Method for producing ss-heteroaryl-alpha-alanine compounds using 2-amino-2-(heteroarylmethyl) carboxylic acid compounds CHIRACON GMBH (DE) 2005-04-14 — — US disclosed
CN-86102923-A The method for preparing antibiotic derivatives — 1986-11-12 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050080263-A1 Method for producing ss-heteroaryl-alpha-alanine compounds using 2-amino-2-(heteroarylmethyl) carboxylic acid compounds AAAS, ASNS, AADAT GRIK1 3027/4885GRIK2 1869/4885GRM1 3272/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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