SCHEMBL5217285

SCHEMBL5217285

COC(=O)CCc1ccc(OCC(C)c2oc(-c3ccc(B4OC(C)(C)C(C)(C)O4)cc3)nc2C(C)C)cc1C

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 6/20 0.34
VDR P11473 1/20 0.34
PPARG P37231 10/20 0.33
PPARA Q07869 9/20 0.33
MAPT P10636 2/20 0.33
AAK1 Q2M2I8 1/20 0.33
LIPG Q9Y5X9 2/20 0.33
HIF1A Q16665 1/20 0.32
SNCA P37840 1/20 0.32
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32
LPL P06858 1/20 0.32
LMNA P02545 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL5219009 0.90 LIPG (0.34) PPARDVDRPPARGPPARAAAK1
SCHEMBL6616289 0.87 PPARG (0.39) PPARDVDRPPARGPPARA
SCHEMBL5218950 0.86 PPARD (0.37) PPARDVDRPPARGPPARAMAPT
SCHEMBL5850733 0.84 PPARA (0.41) PPARDPPARGPPARA
SCHEMBL5215912 0.83 SNCA (0.41) PPARDPPARGPPARAAAK1LIPG
SCHEMBL4673659 0.81 PPARG (0.53) PPARDPPARGPPARA
SCHEMBL6613517 0.79 VDR (0.40) PPARDVDRPPARGPPARAMAPT
SCHEMBL5850788 0.78 PPARG (0.51) PPARDPPARGPPARA
SCHEMBL5851098 0.77 PPARD (0.38) PPARDVDRPPARGPPARACCNC
SCHEMBL5220515 0.77 PPARG (0.51) PPARDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480640-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2007-08-15 EP disclosed
US-7153878-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2006-12-26 US disclosed
US-20050107449-A1 Peroxisome proliferator activated receptor modulators ELILILLY AND COMPANY 2005-05-19 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 (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-20050107449-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARD 3/4885VDR 76/4885PPARG 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.