SCHEMBL5356938

SCHEMBL5356938

CCO[C@@H](Cc1ccc(OC(C)(C)C(=O)NCCc2ccc(Cl)cc2Cl)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.47
PPARA Q07869 10/20 0.46
PPARG P37231 6/20 0.46
ALDH1A1 P00352 2/20 0.43
FABP2 P12104 1/20 0.43
PPARD Q03181 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR1 P21554 6/20 0.43
CNR2 P34972 5/20 0.43
HPGD P15428 1/20 0.42
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL5358154 0.91 TRPV1 (0.48) TRPV1PPARAPPARGALDH1A1FABP2
SCHEMBL5363120 0.89 PPARA (0.47) TRPV1PPARAPPARGPPARDCNR1
SCHEMBL5361930 0.86 PPARA (0.48) TRPV1PPARAPPARGALDH1A1FABP2
SCHEMBL5364799 0.84 PPARA (0.47) TRPV1PPARAPPARGPPARDCNR1
SCHEMBL5372810 0.83 PPARA (0.51) PPARAPPARGALDH1A1FABP2PPARD
SCHEMBL5905599 0.83 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL5905596 0.83 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL5360692 0.83 PPARA (0.47) PPARAPPARGALDH1A1SMN1; SMN2HPGD
SCHEMBL5360686 0.83 PPARA (0.47) PPARAPPARGALDH1A1SMN1; SMN2HPGD
SCHEMBL5365638 0.82 PPARA (0.48) TRPV1PPARAPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220880-B2 Amide linker peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-05-22 US claimed
US-20060111406-A1 Amide linker peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2006-05-25 US claimed
EP-1517882-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-30 EP claimed
WO-2004000789-A9 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2004-03-11 WO claimed
WO-2004000789-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-12-31 WO claimed
US-7220880-B2 Amide linker peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-05-22 US disclosed
US-7220880-B2 Amide linker peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-05-22 US disclosed
US-20060111406-A1 Amide linker peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2006-05-25 US disclosed
EP-1517882-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-30 EP disclosed
WO-2004000789-A9 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2004-03-11 WO disclosed
WO-2004000789-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-12-31 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-20060111406-A1 Amide linker peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD TRPV1 1348/4885PPARA 2/4885PPARG 1/4885

“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.