SCHEMBL22728604

SCHEMBL22728604

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.42
SRR Q9GZT4 1/20 0.42
GRIK1 P39086 2/20 0.39
GRIK2 Q13002 2/20 0.39
GRM1 Q13255 2/20 0.39
GRM2 Q14416 2/20 0.39
GRM8 O00222 1/20 0.39
GRM6 O15303 1/20 0.39
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GSR P00390 1/20 0.39
CYP1A2 P05177 1/20 0.39
GRM5 P41594 1/20 0.39
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
GRIA4 P48058 1/20 0.39

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
SCHEMBL28219859 0.97 LDHA (0.40) LDHASRRGRIK1GRIK2GRM1
Hydrochloric Acid SCHEMBL5422917 0.97 LDHA (0.40) LDHASRRGRIK1GRIK2GRM1
Hydrochloric Acid SCHEMBL5422913 0.97 LDHA (0.40) LDHASRRGRIK1GRIK2GRM1
Malonic Acid SCHEMBL9786773 0.82 LDHA (0.56) LDHASRRGRIK1GRIK2GRM1
SCHEMBL8585811 0.77
SCHEMBL1332607 0.76 GRM8 (0.48) GRIK1GRIK2GRM1GRM2GRM8
SCHEMBL133286 0.74
SCHEMBL133287 0.74
SCHEMBL27324011 0.74
SCHEMBL1468656 0.74 LDHA (0.38) LDHASRRGRIK1GRIK2GRM1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114373510-B Metabolic marker for diagnosing or monitoring lung cancer and screening method and application thereof 武汉迈特维尔医学科技有限公司 2023-12-01 CN disclosed
WO-2023083197-A1 METABOLIC MARKER FOR DIAGNOSING OR MONITORING LUNG CANCER, AND SCREENING METHOD THEREFOR AND USE THEREOF 武汉迈特维尔医学科技有限公司 2023-05-19 WO disclosed
CN-114373510-A Metabolic marker for lung cancer diagnosis or monitoring and screening method and application thereof 武汉迈特维尔生物科技有限公司 2022-04-19 CN disclosed
US-10905731-B2 Methods and related compositions for reducing oxidative stress GATEWAY HEALTH ALLIANCES, INC. 2021-02-02 US disclosed
US-20200376058-A1 METHODS AND RELATED COMPOSITIONS FOR REDUCING OXIDATIVE STRESS GATEWAY HEALTH ALLIANCES, INC. 2020-12-03 US 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 (2 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-10905731-B2 Methods and related compositions for reducing oxidative stress CAT, PRDX3, PRDX6 LDHA 1375/4885SRR 2370/4885GRIK1 425/4885
US-20200376058-A1 METHODS AND RELATED COMPOSITIONS FOR REDUCING OXIDATIVE STRESS CAT, PRDX3, PRDX6 LDHA 1375/4885SRR 2370/4885GRIK1 425/4885

“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.