SCHEMBL5518641

SCHEMBL5518641

CCOC(=O)COc1ccc(S(=O)(=O)Cc2oc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1C

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 14/20 0.58
PPARA Q07869 6/20 0.58
PPARG P37231 7/20 0.57
PTGDR2 Q9Y5Y4 2/20 0.44
ESR1 P03372 1/20 0.41
PTPN1 P18031 1/20 0.41
CETP P11597 2/20 0.40

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
SCHEMBL5508430 0.91 PPARD (0.70) PPARDPPARAPPARGPTGDR2PTPN1
SCHEMBL5515760 0.83 PPARD (0.82) PPARDPPARAPPARG
SCHEMBL4852696 0.76 PPARD (0.49) PPARDPPARAPPARGPTPN1CETP
SCHEMBL820652 0.75 PPARD (0.58) PPARDPPARAPPARGPTPN1
SCHEMBL4856484 0.75 PPARD (0.52) PPARDPPARAPPARGPTPN1CETP
SCHEMBL6235983 0.75 PPARD (0.83) PPARDPPARAPPARG
SCHEMBL6238213 0.73 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL4854406 0.73 PPARD (0.70) PPARDPPARAPPARGPTPN1
SCHEMBL3819065 0.73 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL4856754 0.72 PPARD (0.45) PPARDPPARAPPARGPTPN1CETP

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.