SCHEMBL4817129

SCHEMBL4817129

CC(C)(C)OC(=O)N[C@@H](CSCc1ccc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.61
PPARG P37231 10/20 0.61
PPARD Q03181 2/20 0.59
ACE P12821 1/20 0.46
ICMT O60725 1/20 0.44
PTPN1 P18031 1/20 0.44
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
C3AR1 Q16581 1/20 0.42

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
SCHEMBL3863447 1.00 PPARA (0.61) PPARAPPARGPPARDACEICMT
SCHEMBL13897522 0.96 PPARA (0.58) PPARAPPARGPPARDACEICMT
SCHEMBL3866049 0.96 PPARA (0.58) PPARAPPARGPPARDACEICMT
SCHEMBL13897395 0.94 PPARA (0.55) PPARAPPARGPPARDACEICMT
SCHEMBL3866908 0.94 PPARA (0.55) PPARAPPARGPPARDACEICMT
SCHEMBL3863904 0.93 PTPN1 (0.55) PPARAPPARGPPARDICMTPTPN1
SCHEMBL3866499 0.92 PPARA (0.50) PPARAPPARGPPARDPTPN1CTSS
SCHEMBL3866879 0.92 PPARA (0.50) PPARAPPARGPPARDPTPN1CTSS
SCHEMBL13897433 0.91 PPARA (0.51) PPARAPPARGPPARDICMTPTPN1
SCHEMBL3869403 0.90 PPARA (0.54) PPARAPPARGPPARDACEICMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7358248-B2 Substituted amino carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US claimed
US-20040266789-A1 Substituted amino carboxylic acids INSTITUTE FOR DIABETES DISCOVERY, L.L.C. 2004-12-30 US claimed
US-7498356-B2 Substituted amino carboxylic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2009-03-03 US disclosed
US-7358248-B2 Substituted amino carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US disclosed
US-7358248-B2 Substituted amino carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US disclosed
US-7358248-B2 Substituted amino carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US disclosed
US-20040266789-A1 Substituted amino carboxylic acids INSTITUTE FOR DIABETES DISCOVERY, L.L.C. 2004-12-30 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-20040266789-A1 Substituted amino carboxylic acids PTPRS, PPM1B, PTPRO PPARA 406/4885PPARG 448/4885PPARD 1036/4885

“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.