SCHEMBL6364104

SCHEMBL6364104

CCCCCCCN(CCc1cccc(OC(C)(CC)C(=O)O)c1)C(=O)Cc1cccnc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.52
PPARG P37231 10/20 0.52
PPARD Q03181 2/20 0.42
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP2D6 P10635 2/20 0.39
KCNA5 P22460 1/20 0.39
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
CNR2 P34972 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
SCHEMBL6422826 0.90 PPARA (0.53) PPARAPPARGTDP1L3MBTL1TRPV1
SCHEMBL6356366 0.87 PPARA (0.55) PPARAPPARGPPARD
SCHEMBL6544584 0.86 PPARA (0.54) PPARAPPARGPPARDCYP2D6CNR2
SCHEMBL6361346 0.86 PPARA (0.54) PPARAPPARGPPARDCYP2D6CNR2
SCHEMBL6545379 0.86 PPARA (0.54) PPARAPPARGPPARDCYP2D6CNR2
SCHEMBL6359324 0.86 PPARA (0.53) PPARAPPARGPPARDCYP2D6CNR2
SCHEMBL6358183 0.86 PPARA (0.59) PPARAPPARGPPARDTDP1CNR2
SCHEMBL6359144 0.85 PPARA (0.53) PPARAPPARGPPARDCNR2
SCHEMBL6363619 0.85 PPARA (0.53) PPARAPPARGPPARDCYP2D6CNR2
SCHEMBL6360237 0.84 PPARA (0.52) PPARAPPARGPPARDCYP2D6CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075377-A1 PPAR compounds PFIZER INC 2005-04-07 US disclosed
US-20020169192-A1 PPAR compounds HAYWARD CHERYL M (US) 2002-11-14 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 (2 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-20020169192-A1 PPAR compounds PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885PPARD 3/4885
US-20050075377-A1 PPAR compounds PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885PPARD 3/4885

“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.