SCHEMBL5382097

SCHEMBL5382097

CO[C@@H](Cc1ccc(OCCOc2cccc(C(=O)O)c2)cc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.67
PPARD Q03181 9/20 0.67
PPARA Q07869 9/20 0.67
KMT2A Q03164 1/20 0.56
PLA2G4B P0C869 2/20 0.52
NR4A2 P43354 4/20 0.49
NR4A1 P22736 1/20 0.48
NR4A3 Q92570 1/20 0.48
PKM P14618 2/20 0.48
TP53 P04637 1/20 0.48
NFKB1 P19838 1/20 0.48
RAB9A P51151 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48

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
SCHEMBL5382093 1.00 PPARG (0.67) PPARGPPARDPPARAKMT2APLA2G4B
SCHEMBL5380001 0.96 PPARG (0.72) PPARGPPARDPPARAKMT2APLA2G4B
SCHEMBL5380006 0.96 PPARG (0.72) PPARGPPARDPPARAKMT2APLA2G4B
SCHEMBL5380299 0.88 PPARG (0.60) PPARGPPARDPPARAKMT2APLA2G4B
SCHEMBL5389721 0.88 PPARG (0.69) PPARGPPARDPPARA
SCHEMBL27674877 0.87 PPARA (0.72) PPARGPPARDPPARAPLA2G4BPKM
SCHEMBL5394822 0.87 PPARG (0.84) PPARGPPARDPPARA
SCHEMBL5374910 0.86 PPARG (0.63) PPARGPPARDPPARASMN1; SMN2
SCHEMBL27654978 0.85 PPARA (0.76) PPARGPPARDPPARA
SCHEMBL5375031 0.85 PPARG (0.77) PPARGPPARDPPARA

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
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-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 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.