SCHEMBL29974620

SCHEMBL29974620

CC[C@@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAGI3 Q5TCQ9 1/20 0.56
▸ TASP1 Q9H6P5 1/20 0.52
▸ CASP1 P29466 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ CASP4 P49662 1/20 0.47
▸ CASP5 P51878 1/20 0.47
▸ CASP9 P55211 1/20 0.47
▸ CASP6 P55212 1/20 0.47
▸ CASP8 Q14790 1/20 0.47
▸ CASP10 Q92851 1/20 0.47
▸ ENPEP Q07075 5/20 0.44
▸ CTSD P07339 3/20 0.42
▸ REN P00797 1/20 0.41
▸ BACE1 P56817 1/20 0.40

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
SCHEMBL29974746 1.00 MAGI3 (0.56) MAGI3TASP1CASP1CASP3CASP4
SCHEMBL29974699 0.96 MAGI3 (0.53) MAGI3TASP1CASP1CASP3CASP4
SCHEMBL7067113 0.86 TASP1 (0.62) MAGI3TASP1CASP1CASP3CASP4
SCHEMBL29975231 0.84 ACE (0.53) MAGI3TASP1CASP1CASP3CASP4
SCHEMBL7610443 0.83 CTSS (0.48) MAGI3CASP1CASP3CASP4CASP5
SCHEMBL7610438 0.83 CTSS (0.48) MAGI3CASP1CASP3CASP4CASP5
SCHEMBL30682563 0.83 GNPAT (0.43) MAGI3TASP1BACE1
SCHEMBL20335576 0.83 TASP1 (0.47) MAGI3TASP1CASP1CASP3CASP4
SCHEMBL21515972 0.83 TASP1 (0.47) MAGI3TASP1CASP1CASP3CASP4
SCHEMBL20335572 0.83 TASP1 (0.47) MAGI3TASP1CASP1CASP3CASP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230399361-A1 MACROCYCLIC PEPTIDES UNIVERSITY OF NOTRE DAME DU LAC 2023-12-14 — — US claimed
US-20240116984-A1 MODIFIED PEPTIDES FOR THE INHIBITION OF ABNORMAL TAU ACCUMULATION NATIONAL SCIENCE FOUNDATION 2024-04-11 — — US disclosed
EP-4329791-A1 MODIFIED PEPTIDES FOR THE INHIBITION OF ABNORMAL TAU ACCUMULATION University of Notre Dame du Lac (US) 2024-03-06 — — EP disclosed
US-20230399361-A1 MACROCYCLIC PEPTIDES UNIVERSITY OF NOTRE DAME DU LAC 2023-12-14 — — US disclosed
WO-2022232007-A1 MODIFIED PEPTIDES FOR THE INHIBITION OF ABNORMAL TAU ACCUMULATION UNIVERSITY OF NOTRE DAME DU LAC (US) 2022-11-03 — — 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 (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-20240116984-A1 MODIFIED PEPTIDES FOR THE INHIBITION OF ABNORMAL TAU ACCUMULATION PRNP, MAPT, APP MAGI3 1172/4885TASP1 590/4885CASP1 2252/4885
US-20230399361-A1 MACROCYCLIC PEPTIDES APP, MAPT, NEFM MAGI3 2744/4885TASP1 603/4885CASP1 880/4885

“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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