SCHEMBL5852080

SCHEMBL5852080

Cc1nc(-c2ccc(C(F)(F)F)cc2)oc1C(C)Oc1cccc(CC(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 9/20 0.50
PPARG P37231 7/20 0.50
PPARA Q07869 6/20 0.49
PTPN1 P18031 5/20 0.48
CYP2C9 P11712 1/20 0.47
KCNH2 Q12809 1/20 0.47
VDR P11473 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
RXRA P19793 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 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
SCHEMBL5852097 0.91 PPARD (0.59) PPARDPPARGPPARAPTPN1CYP2C9
SCHEMBL14432285 0.85 PPARD (0.54) PPARDPPARGPPARAPTPN1PTGDR2
SCHEMBL5219166 0.85 PPARD (0.54) PPARDPPARGPPARAPTPN1PTGDR2
SCHEMBL5850797 0.82 PPARD (0.45) PPARDPPARGPPARAPTPN1CYP2C9
SCHEMBL4057018 0.81 PPARG (0.52) PPARDPPARGPPARACYP2C9KCNH2
SCHEMBL6613591 0.81 PPARD (0.47) PPARDPPARGPPARAPTPN1CYP2C9
SCHEMBL6614798 0.80 PPARG (0.58) PPARDPPARGPPARAPTPN1CYP2C9
SCHEMBL5852561 0.80 PPARA (0.46) PPARDPPARGPPARAPTPN1CYP2C9
SCHEMBL4674437 0.80 PPARG (0.69) PPARGPPARAPTPN1CYP2C9KCNH2
SCHEMBL5215031 0.80 PPARD (0.58) PPARDPPARGPPARAPTPN1

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-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
EP-1480640-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-12-01 EP disclosed
WO-2003072100-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-20050107449-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARD 3/4885PPARG 1/4885PPARA 2/4885

“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.