SCHEMBL30744273

SCHEMBL30744273

O=C(O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CCCC[C@H]1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.47
▸ CASP3 P42574 3/20 0.47
▸ ACE P12821 3/20 0.46
▸ ACE2 Q9BYF1 2/20 0.46
▸ MDM4 O15151 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ LTA4H P09960 3/20 0.45
▸ KMT2A Q03164 1/20 0.44
▸ MDM2 Q00987 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
SCHEMBL30057736 0.97 PRCP (0.49) PRCPCASP3ACEACE2MDM4
SCHEMBL31164831 0.90 ACE (0.54) ACEACE2LTA4H
SCHEMBL31164828 0.90 ACE (0.54) ACEACE2LTA4H
SCHEMBL30849154 0.89 ACE (0.47) PRCPCASP3ACEACE2MDM4
SCHEMBL24579222 0.87 ACE (0.58) ACEACE2LTA4H
SCHEMBL29613906 0.87 ACE (0.58) ACEACE2LTA4H
SCHEMBL29696658 0.87 ACE (0.58) ACEACE2LTA4H
SCHEMBL29697676 0.87 ACE (0.58) ACEACE2LTA4H
SCHEMBL24580400 0.86 PRCP (0.52) PRCPACEACE2MDM4TP53
SCHEMBL29583278 0.86 ACE (0.51) PRCPACEACE2KMT2A

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
CN-118772227-A Method for synthesizing peptides containing N-substituted amino acids 中外制药株式会社 2024-10-15 — — CN disclosed
CN-110799520-B Method for synthesizing peptides containing N-substituted amino acids 中外制药株式会社 2024-07-12 — — CN disclosed
US-11891457-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-02-06 — — 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 (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-11891457-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R PRCP 90/4885CASP3 343/4885ACE 621/4885

“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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