SCHEMBL10035732

SCHEMBL10035732

CCC[C@H]1C(=O)O[C@@H]1C(=O)NCCC[C@H](NC(=O)[C@H](C)NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 11/20 0.62
▸ FASN P49327 2/20 0.62
▸ PSMB1 P20618 5/20 0.54
▸ PSMB2 P49721 3/20 0.46
▸ PSMB11 A5LHX3 2/20 0.46
▸ PSMD11 O00231 2/20 0.46
▸ PSMD12 O00232 2/20 0.46
▸ PSMD14 O00487 2/20 0.46
▸ PSMA7 O14818 2/20 0.46
▸ PSMD3 O43242 2/20 0.46
▸ PSMC3 P17980 2/20 0.46
▸ PSMA1 P25786 2/20 0.46
▸ PSMA2 P25787 2/20 0.46
▸ PSMA3 P25788 2/20 0.46
▸ PSMA4 P25789 2/20 0.46
▸ PSMB8 P28062 2/20 0.46
▸ PSMB9 P28065 2/20 0.46
▸ PSMA5 P28066 2/20 0.46
▸ PSMB4 P28070 2/20 0.46
▸ PSMB6 P28072 2/20 0.46

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
SCHEMBL8231027 1.00 PSMB5 (0.62) PSMB5FASNPSMB1PSMB2PSMB11
SCHEMBL10035734 1.00 PSMB5 (0.62) PSMB5FASNPSMB1PSMB2PSMB11
SCHEMBL8232847 1.00 PSMB5 (0.62) PSMB5FASNPSMB1PSMB2PSMB11
SCHEMBL10035731 0.94 PSMB5 (0.70) PSMB5FASNPSMB1PSMB2CTSL
SCHEMBL8231642 0.94 PSMB5 (0.70) PSMB5FASNPSMB1PSMB2CTSL
SCHEMBL8234600 0.94 PSMB5 (0.70) PSMB5FASNPSMB1PSMB2CTSL
SCHEMBL10035730 0.94 PSMB5 (0.70) PSMB5FASNPSMB1PSMB2CTSL
SCHEMBL10067254 0.90 PSMB5 (0.56) PSMB5FASNPSMB1PSMB2PSMB11
SCHEMBL10067250 0.90 PSMB5 (0.56) PSMB5FASNPSMB1PSMB2PSMB11
SCHEMBL8230653 0.89 PSMB5 (0.53) PSMB5FASNPSMB1PSMB2PSMB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119653-B2 Belactosin derivatives as therapeutic agents/biological probes and their synthesis THE TEXAS A&M UNIVERSITY SYSTEM (US) 2012-02-21 — — US disclosed
US-20090042922-A1 NOVEL BELACTOSIN DERIVATIVES AS THERAPEUTIC AGENTS/BIOLOGICAL PROBES AND THEIR SYNTHESIS NATIONAL SCIENCE FOUNDATION 2009-02-12 — — 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-20090042922-A1 NOVEL BELACTOSIN DERIVATIVES AS THERAPEUTIC AGENTS/BIOLOGICAL PROBES AND THEIR SYNTHESIS PSMB1, PSMB10, PBK PSMB5 23/4885FASN 2739/4885PSMB1 1/4885

“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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