SCHEMBL25863476

SCHEMBL25863476

C[C@@H](NC(=O)CCCC(=O)ON1C(=O)CCC1=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)Nc1ccc(COC(N)=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 3/20 0.44
▸ PSMB1 P20618 2/20 0.44
▸ PSMB2 P49721 2/20 0.44
▸ REN P00797 9/20 0.43
▸ SIRT1 Q96EB6 2/20 0.42
▸ SIRT2 Q8IXJ6 1/20 0.42
▸ SIRT5 Q9NXA8 1/20 0.42
▸ PSMB8 P28062 1/20 0.42
▸ PSMB9 P28065 1/20 0.42
▸ KLK7 P49862 1/20 0.41
▸ KLK5 Q9Y337 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
SCHEMBL21097236 0.92 SIRT1 (0.40) PSMB5PSMB1PSMB2SIRT1SIRT2
SCHEMBL25863358 0.90 SIRT5 (0.52) PSMB5PSMB1PSMB2RENSIRT1
SCHEMBL21097237 0.82 PSMB8 (0.49) PSMB5SIRT1SIRT2SIRT5PSMB8
SCHEMBL21097238 0.81 SIRT5 (0.49) PSMB5PSMB2SIRT1SIRT2SIRT5
SCHEMBL18774075 0.81 SIRT2 (0.50) PSMB5SIRT1SIRT2SIRT5PSMB8
SCHEMBL25863218 0.80 MMP3 (0.34) RENSIRT1SIRT2SIRT5
SCHEMBL18752309 0.80 SIRT2 (0.49) PSMB5SIRT1SIRT2SIRT5PSMB8
SCHEMBL18782520 0.76 KLK7 (0.53) SIRT1SIRT2KLK7KLK5
SCHEMBL18770780 0.76 KLK7 (0.53) SIRT1SIRT2KLK7KLK5
SCHEMBL18770781 0.76 KLK7 (0.53) SIRT1SIRT2KLK7KLK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11696956-B2 Bicyclic peptide ligands specific for EphA2 BICYCLETX LIMITED (GB) 2023-07-11 — — 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-11696956-B2 Bicyclic peptide ligands specific for EphA2 EPHA2, EPHB2, ERBB2 PSMB5 3617/4885PSMB1 4280/4885PSMB2 3834/4885

“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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