SCHEMBL1468656

SCHEMBL1468656

C=C(CC(=O)O)C(N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.38
SRR Q9GZT4 1/20 0.38
GRIK1 P39086 3/20 0.38
GRIK2 Q13002 3/20 0.38
GRM1 Q13255 2/20 0.38
GRM2 Q14416 2/20 0.38
GRM8 O00222 1/20 0.36
GRM6 O15303 1/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GSR P00390 1/20 0.36
CYP1A2 P05177 1/20 0.36
GRM5 P41594 1/20 0.36
GRIA1 P42261 1/20 0.36
GRIA2 P42262 1/20 0.36
GRIA3 P42263 1/20 0.36
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
GRIA4 P48058 1/20 0.36

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
SCHEMBL1468654 1.00 LDHA (0.38) LDHASRRGRIK1GRIK2GRM1
SCHEMBL5321730 0.83 ALOX15 (0.38) GRIK1GRIK2GRM1GRM2GRM8
SCHEMBL5321722 0.83 ALOX15 (0.38) GRIK1GRIK2GRM1GRM2GRM8
Malonic Acid SCHEMBL9786773 0.78 LDHA (0.56) LDHASRRGRIK1GRIK2GRM1
SCHEMBL27718257 0.77
SCHEMBL865855 0.75
SCHEMBL25661405 0.75
SCHEMBL865856 0.75
SCHEMBL22728604 0.74 LDHA (0.42) LDHASRRGRIK1GRIK2GRM1
SCHEMBL7033320 0.74 LDHA (0.42) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9416248-B2 Molasses binder KNAUF INSULATION, INC. (US) 2016-08-16 US disclosed
US-20150065646-A1 MOLASSES BINDER KNAUF INSULATION, INC. 2015-03-05 US disclosed
CN-101378820-B Molded filter PSI GLOBAL LTD 2012-07-04 CN disclosed
CN-102449218-A Soft fiber insulation product OWENS CORNING INTELLECTUAL CAP 2012-05-09 CN disclosed
US-20110071101-A1 Nucleoside Phosphonate Analogs BOOJAMRA CONSTANTINE G 2011-03-24 US disclosed
CN-101378820-A Molded filter PSI GLOBAL LTD (GB) 2009-03-04 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-20110071101-A1 Nucleoside Phosphonate Analogs TYMP, PNP, NUDT1 LDHA 1474/4885SRR 2217/4885GRIK1 3521/4885

“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.