SCHEMBL6069937

SCHEMBL6069937

O=C(O)[C@H]1O[C@@H]1C(=O)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ TDP1 Q9NUW8 1/20 0.46
▸ LMNA P02545 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ MAPT P10636 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ SUCNR1 Q9BXA5 1/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ REN P00797 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
SCHEMBL6069582 0.83 NPC1 (0.53) MEN1KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL17667166 0.82 ALDH1A1 (0.55) MEN1KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL17667165 0.82 ALDH1A1 (0.55) MEN1KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL12256482 0.78 MEN1 (0.40) MEN1KMT2ALMNAALDH1A1NPSR1
SCHEMBL8826133 0.77 MEN1 (0.54) MEN1KMT2ATDP1LMNAALDH1A1
SCHEMBL8496217 0.77 MEN1 (0.54) MEN1KMT2ATDP1LMNAALDH1A1
SCHEMBL8496214 0.77 MEN1 (0.54) MEN1KMT2ATDP1LMNAALDH1A1
SCHEMBL8496219 0.77 MEN1 (0.54) MEN1KMT2ATDP1LMNAALDH1A1
SCHEMBL8826139 0.77 MEN1 (0.54) MEN1KMT2ATDP1LMNAALDH1A1
SCHEMBL6070017 0.76 ALOX5 (0.50) MEN1KMT2ATDP1SUCNR1

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-7056947-B2 For inhibiting (cysteine) proteases/caspases; for treatment of viral infections, stroke, neurodegenerative disease, and inflammatory diseases GEORGIA TECH RESEARCH CORP. (US) 2006-06-06 — — US disclosed
US-20040048327-A1 Aza-peptide epoxides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-03-11 — — US disclosed
WO-2004005270-A1 AZA-PEPTIDE EPOXIDES GEORGIA TECH RESEARCH CORPORATION (US) 2004-01-15 — — 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-20040048327-A1 Aza-peptide epoxides ANPEP, ENPEP, TMPRSS15 MEN1 3405/4885KMT2A 2281/4885TDP1 1050/4885

“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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