SCHEMBL4823488

SCHEMBL4823488

CC(C)(C)OC(=O)NC(CSCc1ccc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1F)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.46
PPARG P37231 9/20 0.46
PPARD Q03181 2/20 0.45
SCN9A Q15858 1/20 0.41
ICMT O60725 1/20 0.40
SLC17A5 Q9NRA2 1/20 0.39
PTPN1 P18031 2/20 0.38
CTSS P25774 3/20 0.38
CTSK P43235 3/20 0.38
CTSB P07858 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
CYP3A4 P08684 1/20 0.36

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
SCHEMBL3875723 0.97 PPARG (0.46) PPARAPPARGPPARDSCN9AICMT
SCHEMBL3863501 0.91 PPARA (0.46) PPARAPPARGPPARDSCN9AICMT
SCHEMBL13897433 0.89 PPARA (0.51) PPARAPPARGPPARDSCN9AICMT
SCHEMBL3866908 0.89 PPARA (0.55) PPARAPPARGPPARDSCN9AICMT
SCHEMBL13897395 0.89 PPARA (0.55) PPARAPPARGPPARDSCN9AICMT
SCHEMBL4817129 0.88 PPARA (0.61) PPARAPPARGPPARDICMTPTPN1
SCHEMBL3863447 0.88 PPARA (0.61) PPARAPPARGPPARDICMTPTPN1
SCHEMBL3867029 0.88 PPARG (0.46) PPARAPPARGPPARDSCN9AICMT
SCHEMBL3869773 0.87 ALOX5 (0.37) ICMT
SCHEMBL13897522 0.87 PPARA (0.58) PPARAPPARGPPARDSCN9AICMT

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-20040266789-A1 Substituted amino carboxylic acids INSTITUTE FOR DIABETES DISCOVERY, L.L.C. 2004-12-30 US claimed
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.