SCHEMBL8233297

SCHEMBL8233297

CCCCOC(=O)C(CCCNC(=O)OC(C)(C)C)NC(=O)C(C)NC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.52
▸ CTSL P07711 1/20 0.50
▸ CTSS P25774 1/20 0.50
▸ SIRT2 Q8IXJ6 7/20 0.49
▸ SIRT1 Q96EB6 5/20 0.49
▸ SIRT3 Q9NTG7 4/20 0.49
▸ MAPT P10636 1/20 0.49
▸ KLK7 P49862 1/20 0.48
▸ KLK5 Q9Y337 1/20 0.48
▸ CTSK P43235 2/20 0.48
▸ MMP1 P03956 1/20 0.47
▸ MMP3 P08254 1/20 0.47
▸ MMP9 P14780 1/20 0.47
▸ BCHE P06276 1/20 0.46
▸ ACHE P22303 1/20 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
SCHEMBL10035709 0.93 SYK (0.54) SYKCTSLCTSSMAPTKLK7
SCHEMBL18095595 0.89 SYK (0.54) SYKSIRT2SIRT1MAPTKLK7
SCHEMBL8230136 0.88 CTSL (0.51) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL13599694 0.87 MAPT (0.56) SYKSIRT2SIRT1SIRT3MAPT
SCHEMBL19971941 0.86 SIRT2 (0.53) SYKCTSLCTSSSIRT2SIRT1
SCHEMBL19971949 0.86 SIRT2 (0.53) SYKCTSLCTSSSIRT2SIRT1
SCHEMBL19971948 0.86 SIRT2 (0.53) SYKCTSLCTSSSIRT2SIRT1
SCHEMBL19971942 0.86 SIRT2 (0.53) SYKCTSLCTSSSIRT2SIRT1
SCHEMBL8230194 0.86 TGM2 (0.58) CTSLCTSS
SCHEMBL30065149 0.84 MAPT (0.62) MAPTKLK7KLK5

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
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
WO-2008006113-A2 NOVEL BELACTOSIN DERIVATIVES AS THERAPEUTIC AGENTS/BIOLOGICAL PROBES AND THEIR SYNTHESIS THE TEXAS A & M UNIVERSITY SYSTEM (US) 2008-01-10 — — 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-20090042922-A1 NOVEL BELACTOSIN DERIVATIVES AS THERAPEUTIC AGENTS/BIOLOGICAL PROBES AND THEIR SYNTHESIS PSMB1, PSMB10, PBK SYK 2702/4885CTSL 836/4885CTSS 760/4885

“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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