SCHEMBL5381563

SCHEMBL5381563

CCOC(=O)[C@H](Cc1ccc(OCCCOc2ccc(C(=O)c3ccccc3)cc2)c(Cl)c1)OCC

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.73
PPARD Q03181 12/20 0.73
PPARG P37231 11/20 0.73
LTB4R Q15722 2/20 0.47
LTB4R2 Q9NPC1 2/20 0.47
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 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
SCHEMBL5379836 0.94 PPARA (0.75) PPARAPPARDPPARGLTB4RLTB4R2
SCHEMBL5379834 0.94 PPARA (0.75) PPARAPPARDPPARGLTB4RLTB4R2
SCHEMBL5395195 0.92 PPARA (0.82) PPARAPPARDPPARG
SCHEMBL5379954 0.92 PPARA (0.82) PPARAPPARDPPARG
SCHEMBL14560861 0.91 PPARA (0.74) PPARAPPARDPPARGLTB4RLTB4R2
SCHEMBL14571374 0.85 PPARA (0.87) PPARAPPARDPPARGLTB4RLTB4R2
SCHEMBL5387242 0.84 PPARA (1.00) PPARAPPARDPPARGLTB4RLTB4R2
SCHEMBL5380401 0.84 PPARA (1.00) PPARAPPARDPPARGLTB4RLTB4R2
SCHEMBL5578991 0.83 PPARA (0.68) PPARAPPARDPPARGLMNAMAPK1
SCHEMBL14366489 0.83 PPARA (0.68) PPARAPPARDPPARGLMNAMAPK1

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-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
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

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 PPARA 3/4885PPARD 7/4885PPARG 2/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA PPARA 3/4885PPARD 4/4885PPARG 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.