SCHEMBL4616744

SCHEMBL4616744

Cc1cc(Oc2cccc(CNC(=O)c3[nH]c4ccc(Cl)cc4c3-c3ccccc3)c2)ccc1CCC(=O)O

nearest known ligand 0.84

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.84
PPARD Q03181 11/20 0.84
PPARA Q07869 11/20 0.84
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MCL1 Q07820 2/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
CYP1A2 P05177 1/20 0.48
HPGD P15428 1/20 0.48
XBP1 P17861 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAP2 P11137 2/20 0.46
CNR1 P21554 1/20 0.45
PTGS2 P35354 1/20 0.45

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
SCHEMBL4616277 0.91 PPARG (1.00) PPARGPPARDPPARAMCL1CNR1
SCHEMBL4616779 0.82 PPARG (1.00) PPARGPPARDPPARAKDM4E
SCHEMBL4616733 0.82 PPARG (0.82) PPARGPPARDPPARAALDH1A1KDM4E
SCHEMBL14543906 0.82 PPARG (0.82) PPARGPPARDPPARAALDH1A1KDM4E
SCHEMBL4616518 0.81 PPARG (0.81) PPARGPPARDPPARAMCL1CNR1
SCHEMBL5417014 0.81 PPARG (1.00) PPARGPPARDPPARAKDM4E
SCHEMBL4616755 0.80 PPARG (1.00) PPARGPPARDPPARAKDM4EMCL1
SCHEMBL4616797 0.80 PPARG (0.79) PPARGPPARDPPARA
SCHEMBL4614576 0.80 PPARG (0.79) PPARGPPARDPPARAALDH1A1KDM4E
SCHEMBL6356091 0.79 ALDH1A1 (0.74) ALDH1A1KDM4EPOLBMAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
EP-1697304-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2006-09-06 EP disclosed
WO-2005054176-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-16 WO 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-20070082907-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARG 1/4885PPARD 3/4885PPARA 2/4885

“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.