SCHEMBL3866908

SCHEMBL3866908

CC(C)(C)OC(=O)NC(CSCc1cccc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)c1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.55
PPARG P37231 9/20 0.55
PPARD Q03181 2/20 0.52
CTSB P07858 1/20 0.45
CTSS P25774 1/20 0.45
CTSK P43235 1/20 0.45
GGPS1 O95749 1/20 0.43
ICMT O60725 1/20 0.42
ACE P12821 2/20 0.42
SCN9A Q15858 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
PTPN1 P18031 1/20 0.40
EPHX2 P34913 1/20 0.40

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
SCHEMBL13897395 1.00 PPARA (0.55) PPARAPPARGPPARDCTSBCTSS
SCHEMBL3866899 0.96 PPARA (0.56) PPARAPPARGPPARDCTSBCTSS
SCHEMBL3863447 0.94 PPARA (0.61) PPARAPPARGPPARDCTSSCTSK
SCHEMBL4817129 0.94 PPARA (0.61) PPARAPPARGPPARDCTSSCTSK
SCHEMBL13897522 0.93 PPARA (0.58) PPARAPPARGPPARDCTSBCTSS
SCHEMBL3866049 0.93 PPARA (0.58) PPARAPPARGPPARDCTSBCTSS
SCHEMBL13897433 0.89 PPARA (0.51) PPARAPPARGPPARDCTSSCTSK
SCHEMBL4823488 0.89 PPARA (0.46) PPARAPPARGPPARDCTSBCTSS
SCHEMBL4825641 0.87 PPARA (0.43) PPARAPPARGPPARDCTSBCTSS
SCHEMBL3862977 0.87 GGPS1 (0.45) PPARAPPARGPPARDCTSBCTSS

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-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 328/4885PPARD 741/4885

“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.