SCHEMBL4700864

SCHEMBL4700864

CC(C)(C)OC(=O)N[C@H](CCNOCc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.61
PPARG P37231 4/20 0.56
ACE P12821 1/20 0.54
CTSS P25774 4/20 0.52
CTSK P43235 4/20 0.51
PPARD Q03181 2/20 0.50
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
AKT1 P31749 1/20 0.47
SYK P43405 1/20 0.46
ATM Q13315 1/20 0.46
PTPN1 P18031 1/20 0.46
MAPT P10636 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
SCHEMBL16473048 0.92 PPARA (0.57) PPARAPPARGACECTSKPPARD
SCHEMBL31538727 0.92 PPARA (0.54) PPARAPPARGACECTSSCTSK
SCHEMBL30962415 0.84 MAPT (0.60) PPARAPPARGACECTSSCTSK
SCHEMBL6621271 0.84 MAPT (0.60) PPARAPPARGACECTSSCTSK
SCHEMBL1024713 0.84 MAPT (0.60) PPARAPPARGACECTSSCTSK
SCHEMBL4602404 0.84 MAPT (0.60) PPARAPPARGACECTSSCTSK
SCHEMBL955526 0.82 PPARA (0.74) PPARAPPARGACECTSSCTSK
SCHEMBL1312604 0.82 PPARA (0.74) PPARAPPARGACECTSSCTSK
SCHEMBL955527 0.82 PPARA (0.74) PPARAPPARGACECTSSCTSK
SCHEMBL29865344 0.82 ATM (0.60) PPARAPPARGACECTSSCTSK

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
EP-1444202-B1 NOVEL METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2008-10-15 EP disclosed
US-7132434-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2006-11-07 US disclosed
US-20050026990-A1 Novel metalloproteinase ihibitors ASTRAZENECA AB (SE) 2005-02-03 US disclosed
EP-1444202-A1 NOVEL METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2004-08-11 EP disclosed
WO-2003040098-A1 NOVEL METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2003-05-15 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-20050026990-A1 Novel metalloproteinase ihibitors MMP12, MMP1, MMP16 PPARA 3793/4885PPARG 3197/4885ACE 423/4885

“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.