SCHEMBL5215912

SCHEMBL5215912

COC(=O)CCc1ccc(OCC(C)c2nc(-c3ccc(B4OC(C)(C)C(C)(C)O4)cc3)sc2C)cc1C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.41
PPARD Q03181 6/20 0.39
PPARG P37231 4/20 0.39
PPARA Q07869 3/20 0.39
LIPG Q9Y5X9 1/20 0.35
TARBP2 Q15633 1/20 0.34
AAK1 Q2M2I8 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
HIF1A Q16665 2/20 0.33
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
IDH1 O75874 2/20 0.32
FFAR1 O14842 1/20 0.32
DGAT1 O75907 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
SCHEMBL5218118 0.85 PPARD (0.43) PPARDPPARGPPARATARBP2NPC1
SCHEMBL5217716 0.84 PPARD (0.42) PPARDPPARGPPARATARBP2ADRB2
SCHEMBL5217285 0.83 PPARD (0.34) SNCAPPARDPPARGPPARALIPG
SCHEMBL14433050 0.81 PPARD (0.40) PPARDPPARGPPARATARBP2NPC1
SCHEMBL6616289 0.78 PPARG (0.39) PPARDPPARGPPARA
SCHEMBL5217445 0.77 PPARD (0.41) PPARDPPARGPPARATARBP2ADRB2
SCHEMBL4673659 0.76 PPARG (0.53) PPARDPPARGPPARA
SCHEMBL5219009 0.76 LIPG (0.34) SNCAPPARDPPARGPPARALIPG
SCHEMBL5220255 0.75 PPARD (0.51) PPARDPPARGPPARATARBP2FFAR1
SCHEMBL5215424 0.75 PPARD (0.51) PPARDPPARGPPARATARBP2FFAR1

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 SNCA 4200/4885PPARD 3/4885PPARG 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.