SCHEMBL5383559

SCHEMBL5383559

COc1cc(C[C@H](OC)C(=O)O)ccc1OCCCOc1ccc(Oc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 11/20 1.00
PPARA Q07869 11/20 1.00
PPARG P37231 9/20 1.00
MMP1 P03956 2/20 0.51
LTB4R Q15722 2/20 0.49
LTB4R2 Q9NPC1 2/20 0.49
MAPT P10636 1/20 0.48
LDHA P00338 1/20 0.48
APP P05067 1/20 0.48
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL5377447 1.00 PPARD (1.00) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL14560776 0.93 PPARD (0.86) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL5380790 0.91 PPARG (0.84) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL5375212 0.91 PPARG (0.84) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL5375223 0.91 PPARG (0.84) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL14366504 0.91 PPARG (0.84) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL5379636 0.90 PPARA (0.82) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL14366513 0.90 PPARA (0.82) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL14366511 0.90 PPARG (0.82) PPARDPPARAPPARGMMP1LTB4R
SCHEMBL5381577 0.90 PPARG (0.82) PPARDPPARAPPARGMMP1LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US claimed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 US claimed
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP claimed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 WO claimed

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-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA PPARD 7/4885PPARA 3/4885PPARG 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.