SCHEMBL1817875

SCHEMBL1817875

N[C@H](C[C@H](Cc1cccc(I)c1)C(=O)O)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 3/20 0.69
SLC1A3 P43003 1/20 0.69
SLC1A2 P43004 1/20 0.69
GRIK1 P39086 1/20 0.51
GRM2 Q14416 1/20 0.49
GRM3 Q14832 1/20 0.49
SLC7A5 Q01650 2/20 0.47
ALPI P09923 1/20 0.47
PKM P14618 1/20 0.47
PTGS1 P23219 1/20 0.47
XIAP P98170 1/20 0.47
GRIA2 P42262 1/20 0.47
CYP1A2 P05177 1/20 0.46
NOS3 P29474 2/20 0.46
NOS1 P29475 2/20 0.46
NOS2 P35228 2/20 0.46
ANPEP P15144 1/20 0.45
RNPEP Q9H4A4 1/20 0.45
DNPEP Q9ULA0 1/20 0.45

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
SCHEMBL1820728 1.00 SLC1A1 (0.69) SLC1A1SLC1A3SLC1A2GRIK1GRM2
SCHEMBL159869 0.86 SLC7A5 (0.65) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL159870 0.86 SLC7A5 (0.65) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL29540085 0.86 SLC7A5 (0.65) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL29568166 0.86 SLC7A5 (0.65) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL14935913 0.86 SLC7A5 (0.65) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL14940208 0.84 SLC7A5 (0.62) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL14940391 0.84 SLC7A5 (0.62) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL14940210 0.84 SLC7A5 (0.62) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL133913 0.82 SLC1A1 (1.00) SLC1A1SLC1A3SLC1A2GRIK1GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130034497-A1 IODINE-LABELED HOMOGLUTAMIC ACID AND GLUTAMIC ACID DERIVATIVES PIRAMAL IMAGING SA (CH) 2013-02-07 US disclosed
EP-2501416-A1 IODINE-LABELED HOMOGLUTAMIC ACID AND GLUTAMIC ACID DERIVATIVES Piramal Imaging SA (CH) 2012-09-26 EP disclosed
WO-2011061154-A1 IODINE-LABELED HOMOGLUTAMIC ACID AND GLUTAMIC ACID DERIVATIVES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-26 WO 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-20130034497-A1 IODINE-LABELED HOMOGLUTAMIC ACID AND GLUTAMIC ACID DERIVATIVES GLUL, GCG, GLS SLC1A1 67/4885SLC1A3 63/4885SLC1A2 55/4885

“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.