SCHEMBL5377230

SCHEMBL5377230

COc1cc(CC(OC)C(=O)O)ccc1OCCCOc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.74
PPARD Q03181 6/20 0.74
PPARA Q07869 6/20 0.74
MAPT P10636 1/20 0.60
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
PLA2G4B P0C869 1/20 0.47
RARB P10826 5/20 0.47
MMP1 P03956 2/20 0.46
LDHA P00338 1/20 0.46

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
SCHEMBL5377235 1.00 PPARG (0.74) PPARGPPARDPPARAMAPTPDE4A
SCHEMBL5375223 0.92 PPARG (0.84) PPARGPPARDPPARAMAPTMMP1
SCHEMBL5375212 0.92 PPARG (0.84) PPARGPPARDPPARAMAPTMMP1
SCHEMBL5381577 0.88 PPARG (0.82) PPARGPPARDPPARAMAPTPLA2G4B
SCHEMBL14366511 0.88 PPARG (0.82) PPARGPPARDPPARAMAPTPLA2G4B
SCHEMBL5375613 0.88 PPARA (0.81) PPARGPPARDPPARAPLA2G4BRARB
SCHEMBL5375615 0.88 PPARA (0.81) PPARGPPARDPPARAPLA2G4BRARB
SCHEMBL5374939 0.88 PPARG (0.81) PPARGPPARDPPARAMAPTMMP1
SCHEMBL5396260 0.88 PPARG (0.81) PPARGPPARDPPARAMAPTMMP1
SCHEMBL14366508 0.86 PPARG (0.78) PPARGPPARDPPARAMAPTMMP1

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-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 US disclosed
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 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 (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-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA PPARG 2/4885PPARD 7/4885PPARA 3/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA PPARG 1/4885PPARD 4/4885PPARA 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.