SCHEMBL5031929

SCHEMBL5031929

CCCOc1ccc(COC(=O)NCc2cc(CC3(C(=O)O)CCCO3)ccc2OCC)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.36
PPARG P37231 14/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPARD Q03181 1/20 0.33

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
SCHEMBL5031733 0.91 MAPT (0.39) PPARAPPARGTSHR
SCHEMBL5031840 0.90 ALDH1A1 (0.40) PPARAPPARGALDH1A1MAPK1TSHR
SCHEMBL5140078 0.87 PPARG (0.38) PPARAPPARGPPARD
SCHEMBL5032835 0.87 PPARG (0.38) PPARAPPARGPPARD
SCHEMBL5140949 0.87 PPARG (0.38) PPARAPPARGPPARD
SCHEMBL5031806 0.86 TSHR (0.44) PPARAPPARGALDH1A1MAPK1TSHR
SCHEMBL5031917 0.86 L3MBTL1 (0.37) PPARAPPARGALDH1A1MAPK1PPARD
SCHEMBL5140241 0.83 PPARG (0.46) PPARAPPARGPPARD
SCHEMBL5139405 0.83 PPARG (0.46) PPARAPPARGPPARD
SCHEMBL5032869 0.83 PPARG (0.46) PPARAPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371777-B2 Cyclic compound and PPAR agonist EISAI CO., LTD. (JP) 2008-05-13 US disclosed
US-7371777-B2 Cyclic compound and PPAR agonist EISAI CO., LTD. (JP) 2008-05-13 US disclosed
US-7371777-B2 Cyclic compound and PPAR agonist EISAI CO., LTD. (JP) 2008-05-13 US disclosed
US-20050014833-A1 Cyclic compound and ppar agonist EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-20 US disclosed
EP-1452521-A1 CYCLIC COMPOUND AND PPAR AGONIST Eisai Co., Ltd. (JP) 2004-09-01 EP 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-20050014833-A1 Cyclic compound and ppar agonist PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885ALDH1A1 1662/4885

“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.