SCHEMBL22689972

SCHEMBL22689972

CC(C)(Br)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 1/20 0.54
▸ SLC6A5 Q9Y345 1/20 0.46
▸ CPB2 Q96IY4 8/20 0.45
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ MMP2 P08253 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ GSR P00390 1/20 0.42
▸ CTSK P43235 1/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA9 Q16790 1/20 0.41

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
SCHEMBL13049083 0.87 FOLH1 (0.57) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL29187387 0.87 FOLH1 (0.57) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL18741275 0.85 FOLH1 (0.55) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL29918590 0.85 FOLH1 (0.55) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL18741276 0.85 FOLH1 (0.55) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL22689833 0.84 FOLH1 (0.54) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL28277728 0.84 NOD1 (0.53) FOLH1SLC6A5CA2MMP2
SCHEMBL7165076 0.81 FOLH1 (0.50) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL7165075 0.81 FOLH1 (0.50) FOLH1SLC6A5CPB2CA1CA2
SCHEMBL7165072 0.81 FOLH1 (0.50) FOLH1SLC6A5CPB2CA1CA2

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
US-20230139680-A1 A GENETICALLY ENCODED, PHAGE-DISPLAYED CYCLIC PEPTIDE LIBRARY AND METHODS OF MAKING THE SAME THE TEXAS A&M UNIVERSITY SYSTEM (US) 2023-05-04 — — US disclosed
EP-3972625-A1 A GENETICALLY ENCODED, PHAGE-DISPLAYED CYCLIC PEPTIDE LIBRARY AND METHODS OF MAKING THE SAME The Texas A&M University System (US) 2022-03-30 — — EP disclosed
CN-113727725-A Genetically encoded phage-displayed cyclic peptide libraries and methods of making the same 得克萨斯A&M大学系统 2021-11-30 — — CN disclosed
WO-2020236146-A1 A GENETICALLY ENCODED, PHAGE-DISPLAYED CYCLIC PEPTIDE LIBRARY AND METHODS OF MAKING THE SAME THE TEXAS A&M UNIVERSITY SYSTEM (US) 2020-11-26 — — 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-20230139680-A1 A GENETICALLY ENCODED, PHAGE-DISPLAYED CYCLIC PEPTIDE LIBRARY AND METHODS OF MAKING THE SAME QPCTL, LNPEP, QPCT FOLH1 137/4885SLC6A5 2304/4885CPB2 37/4885

“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.

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