SCHEMBL29677192

SCHEMBL29677192

CN(C[C@H](N)C(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.38
NOS2 P35228 2/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
GRIK1 P39086 2/20 0.35
SLC1A2 P43004 5/20 0.33
SLC1A1 P43005 5/20 0.33
SLC1A3 P43003 4/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC7A11 Q9UPY5 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
KIF11 P52732 1/20 0.32
GRIK2 Q13002 1/20 0.32

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
SCHEMBL15372363 1.00 SLC7A5 (0.38) SLC7A5NOS2NOS3NOS1GRIK1
SCHEMBL1456149 0.81 HDAC6 (0.38) NOS2NOS3NOS1HDAC1HDAC2
SCHEMBL20033588 0.81 HDAC6 (0.38) NOS2NOS3NOS1HDAC1HDAC2
SCHEMBL10473405 0.80 MEN1 (0.34) MEN1GAAKMT2AHDAC1HDAC2
SCHEMBL8280474 0.80 DPP4 (0.35) HDAC1HDAC2HDAC6
SCHEMBL17898137 0.80 MEN1 (0.34) MEN1GAAKMT2AHDAC1HDAC2
SCHEMBL14750621 0.80 MEN1 (0.34) MEN1GAAKMT2AHDAC1HDAC2
SCHEMBL10562696 0.79 SLC7A5 (0.37) SLC7A5GRIK1SLC1A2SLC1A1SLC1A3
SCHEMBL12540999 0.79 NOS2 (0.53) NOS2NOS3NOS1GRIK1SLC1A2
SCHEMBL12541003 0.79 NOS2 (0.53) NOS2NOS3NOS1GRIK1SLC1A2

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
US-11730819-B2 Peptide derivatives having novel linkage structures BICYCLETX LIMITED (GB) 2023-08-22 US disclosed
US-20220194983-A1 PEPTIDE LIGANDS FOR BINDING TO PSMA BICYCLETX LIMITED (GB) 2022-06-23 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-11730819-B2 Peptide derivatives having novel linkage structures DNPEP, LNPEP, ANPEP SLC7A5 135/4885NOS2 3640/4885NOS3 2628/4885
US-20220194983-A1 PEPTIDE LIGANDS FOR BINDING TO PSMA DNPEP, LNPEP, ANPEP SLC7A5 723/4885NOS2 3908/4885NOS3 3363/4885

“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.