SCHEMBL5031971

SCHEMBL5031971

CCOc1ccc(CC2(C(=O)O)CCCO2)cc1CNC(=O)OCc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.39
PPARG P37231 6/20 0.39
PPARD Q03181 4/20 0.39
OPRM1 P35372 5/20 0.37
OPRD1 P41143 5/20 0.37
OPRK1 P41145 5/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TACR1 P25103 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
KCNB1 Q14721 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
MMP12 P39900 1/20 0.34

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
SCHEMBL5030071 0.93 KCNB1 (0.43) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5031917 0.92 L3MBTL1 (0.37) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5036999 0.91 PPARD (0.47) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5031733 0.89 MAPT (0.39) PPARAPPARGL3MBTL1MAPT
SCHEMBL5031746 0.89 PPARG (0.41) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5029863 0.88 RAB9A (0.36) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5029983 0.87 PPARG (0.38) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5029893 0.86 PPARG (0.36) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5036977 0.86 OPRM1 (0.35) PPARAPPARGPPARDOPRM1OPRD1
SCHEMBL5031915 0.86 PPARG (0.44) PPARAPPARGPPARDOPRM1OPRD1

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 2/4885PPARD 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.