SCHEMBL3867282

SCHEMBL3867282

CC(C)(C)OC(=O)NC(COCc1ccc(-c2cccc(-c3cccc4c3oc3ccccc34)c2)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.58
PPARG P37231 2/20 0.56
CTSS P25774 3/20 0.47
PTPN1 P18031 5/20 0.44
KLK7 P49862 2/20 0.43
KLK5 Q9Y337 2/20 0.43
CTSK P43235 2/20 0.41
CTSB P07858 1/20 0.41
CDC25B P30305 4/20 0.41
PTPN2 P17706 3/20 0.41
CDC25A P30304 2/20 0.41
PTPN6 P29350 1/20 0.41
PTPN11 Q06124 1/20 0.41
GGPS1 O95749 1/20 0.41
SCN9A Q15858 1/20 0.41
C3AR1 Q16581 1/20 0.40
RAB9A P51151 1/20 0.40
ACE P12821 1/20 0.40
BCL2 P10415 1/20 0.40
ALOX5 P09917 1/20 0.39

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
SCHEMBL4824028 0.96 PPARA (0.61) PPARAPPARGCTSSPTPN1KLK7
SCHEMBL4824035 0.96 PPARA (0.61) PPARAPPARGCTSSPTPN1KLK7
SCHEMBL13897504 0.94 PPARA (0.56) PPARAPPARGCTSSPTPN1KLK7
SCHEMBL3866049 0.87 PPARA (0.58) PPARAPPARGCTSSCTSKCTSB
SCHEMBL3867265 0.87 C3AR1 (0.49) PPARAPPARGCTSSPTPN1CTSK
SCHEMBL13897592 0.87 PPARA (0.46) PPARAPPARGCTSSPTPN1KLK7
SCHEMBL13897522 0.87 PPARA (0.58) PPARAPPARGCTSSCTSKCTSB
SCHEMBL3864527 0.83 CTSS (0.41) PPARAPPARGCTSSPTPN1CTSK
SCHEMBL3864530 0.83 CTSS (0.41) PPARAPPARGCTSSPTPN1CTSK
SCHEMBL3864792 0.83 FNTA (0.43) PPARAPPARGCTSSPTPN1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498356-B2 Substituted amino carboxylic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2009-03-03 US disclosed
US-7498356-B2 Substituted amino carboxylic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2009-03-03 US disclosed
US-7498356-B2 Substituted amino carboxylic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2009-03-03 US disclosed
US-20060122223-A1 Substituted amino carboxylic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC 2006-06-08 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-20060122223-A1 Substituted amino carboxylic acids PTPRS, PTPRO, PTPRJ PPARA 314/4885PPARG 328/4885CTSS 3741/4885

“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.