SCHEMBL6564073

SCHEMBL6564073

COC(=O)[C@H](C)N1CC[C@@H](NC(=O)OC(C)(C)C)C1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
CTSK P43235 2/20 0.40
FPR2 P25090 1/20 0.39
F2 P00734 1/20 0.38
F10 P00742 1/20 0.38
PRSS1 P07477 1/20 0.38
NFKB1 P19838 3/20 0.38
NFKB2 Q00653 3/20 0.38
RELA Q04206 3/20 0.38
CA12 O43570 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
BTK Q06187 1/20 0.37
NAAA Q02083 2/20 0.37

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
SCHEMBL10795819 0.91 F2 (0.41) GAAF2F10PRSS1BTK
SCHEMBL10795823 0.91 F2 (0.41) GAAF2F10PRSS1BTK
SCHEMBL6800613 0.88 GAA (0.43) GAACTSKF2F10PRSS1
SCHEMBL6802644 0.88 GAA (0.43) GAACTSKF2F10PRSS1
SCHEMBL6800616 0.88 GAA (0.43) GAACTSKF2F10PRSS1
SCHEMBL10264443 0.87 GAA (0.46) GAACTSKFPR2F2F10
SCHEMBL325216 0.87 GAA (0.46) GAACTSKFPR2F2F10
SCHEMBL10833711 0.84 GAA (0.38) GAANFKB1NFKB2RELA
SCHEMBL29865950 0.84 GAA (0.38) GAACTSKF2F10PRSS1
SCHEMBL22648647 0.83 GAA (0.38) GAACTSKFPR2F2F10

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-1076645-B1 PROCESS FOR THE PREPARATION OF METHYL(2S)-2-[(3R)-3-(N-[TERT-BUTYLOXYCARBONYL]-AMINO) -2-OXOPYRR OLIDIN-1-YL]PROPIONATE ASTRAZENECA AB (SE) 2004-03-03 EP disclosed
US-20020187934-A1 Peptide derivatives SYNGENTA LIMITED (GB) 2002-12-12 US disclosed
EP-1076645-A1 PROCESS FOR THE PREPARATION OF METHYL(2S)-2-[(3R)-3-(N-[TERT-BUTYLOXYCARBONYL]-AMINO) -2-OXOPYRR OLIDIN-1-YL]PROPIONATE AstraZeneca AB (SE) 2001-02-21 EP disclosed
WO-1999055669-A1 PROCESS FOR THE PREPARATION OF METHYL(2S)-2-[(3R)-3-(N-[TERT-BUTYLOXYCARBONYL]-AMINO)-2-OXOPYRROLIDIN-1-YL]PROPIONATE ASTRAZENECA AB (SE) 1999-11-04 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-20020187934-A1 Peptide derivatives HLA-DRB1, MICA, TAP1 GAA 4428/4885CTSK 1972/4885FPR2 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.