SCHEMBL8239135

SCHEMBL8239135

COC(=O)[C@H](COc1ccc(Br)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
MAPT P10636 2/20 0.49
CTSS P25774 2/20 0.49
CTSK P43235 2/20 0.49
AAK1 Q2M2I8 6/20 0.47
CACNA1B Q00975 1/20 0.46
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
HDAC8 Q9BY41 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
MMP13 P45452 1/20 0.42
KLK5 Q9Y337 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 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
SCHEMBL345998 1.00 ALDH1A1 (0.49) ALDH1A1MAPTCTSSCTSKAAK1
SCHEMBL8239145 0.88 ITGB3 (0.54) ALDH1A1MAPTCTSSCTSKAAK1
SCHEMBL345468 0.88 ITGB3 (0.54) ALDH1A1MAPTCTSSCTSKAAK1
SCHEMBL17491981 0.87 ALDH1A1 (0.49) ALDH1A1MAPTCACNA1BITGB3ITGA2B
SCHEMBL17491980 0.87 ALDH1A1 (0.49) ALDH1A1MAPTCACNA1BITGB3ITGA2B
SCHEMBL17492177 0.87 NFKB1 (0.52) ALDH1A1CTSSCTSKITGB3ITGA2B
SCHEMBL17492179 0.87 NFKB1 (0.52) ALDH1A1CTSSCTSKITGB3ITGA2B
SCHEMBL345418 0.86 CTSS (0.45) ALDH1A1MAPTCTSSCTSKAAK1
SCHEMBL10151192 0.86 CTSS (0.45) ALDH1A1MAPTCTSSCTSKAAK1
SCHEMBL13897473 0.84 ITGB3 (0.46) ALDH1A1MAPTCTSSCTSKAAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338471-B2 (2,5-dioxoimidazolidin-i-yl)-n-hydroxy-acetamides as metalloproteinase inhibitors MEDIVIR AB (SE) 2012-12-25 US disclosed
US-20120015994-A1 (2,5-DIOXOIMIDAZOLIDIN-I-YL)-N-HYDROXY-ACETAMIDES AS METALLOPROTEINASE INHIBITORS MEDIVIR AB (SE) 2012-01-19 US disclosed
US-8022092-B2 (2,5-dioxoimidazolidin-1-yl)-N-hydroxy-acetamides as metalloproteinase inhibitors MEDIVIR AB (SE) 2011-09-20 US disclosed
US-20090215846-A1 (2,5-DIOXOIMIDAZOLIDIN-I-YL)-N-HYDROXY-ACETAMIDES AS METALLOPROTEINASE INHIBITORS MEDIVIR AB (SE) 2009-08-27 US disclosed
WO-2007068474-A1 (2,5-DIOXOIMIDAZOLIDIN-I-YL)-N-HYDROXY-ACETAMIDES AS METALLOPROTEINASE INHIBITORS MEDIVIR AB (SE) 2007-06-21 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 (2 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-20120015994-A1 (2,5-DIOXOIMIDAZOLIDIN-I-YL)-N-HYDROXY-ACETAMIDES AS METALLOPROTEINASE INHIBITORS MMP12, MMP13, MMP14 ALDH1A1 99/4885MAPT 4159/4885CTSS 186/4885
US-20090215846-A1 (2,5-DIOXOIMIDAZOLIDIN-I-YL)-N-HYDROXY-ACETAMIDES AS METALLOPROTEINASE INHIBITORS MMP12, MMP13, MMP14 ALDH1A1 99/4885MAPT 4159/4885CTSS 186/4885

“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.