SCHEMBL5510677

SCHEMBL5510677

COC(=O)CCc1ccc(C(OC)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1C

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 16/20 0.52
PPARA Q07869 7/20 0.52
PPARG P37231 3/20 0.52
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
FFAR1 O14842 2/20 0.42
MAPT P10636 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
SCHEMBL5515784 0.83 PPARD (0.55) PPARDPPARAPPARGFFAR1MAPT
SCHEMBL1553163 0.79 NPC1 (0.60) PPARDPPARAPPARGNPC1ALDH1A1
SCHEMBL1554129 0.78 ALDH1A1 (0.48) PPARDPPARAPPARGNPC1ALDH1A1
SCHEMBL5510678 0.78 PPARD (0.64) PPARDPPARAPPARGFFAR1MAPT
SCHEMBL5509268 0.78 FFAR1 (0.64) PPARDPPARAPPARGFFAR1
SCHEMBL5516143 0.77 PPARD (0.59) PPARDPPARAPPARGFFAR1MAPT
SCHEMBL5221269 0.76 PPARD (0.55) PPARDPPARAPPARGFFAR1MAPT
SCHEMBL5852164 0.76 PPARD (0.45) PPARDPPARAPPARGNPC1ALDH1A1
SCHEMBL5525583 0.75 PPARD (0.56) PPARDPPARAPPARGFFAR1MAPT
SCHEMBL5216218 0.75 PPARD (0.70) PPARDPPARAPPARGFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7259175-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-08-21 US disclosed
US-20060084663-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY, PATENT DIVISION (US) 2006-04-20 US disclosed
EP-1480642-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-12-01 EP disclosed
WO-2003072102-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-04 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-20060084663-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARD 3/4885PPARA 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.