SCHEMBL4614591

SCHEMBL4614591

COC(=O)CCc1ccc(Oc2cc(F)cc(C(C)NC(=O)c3ccc(C(F)(F)F)cc3Cl)c2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.46
PPARD Q03181 12/20 0.46
PPARA Q07869 12/20 0.46
PTGER4 P35408 2/20 0.36
KCNQ3 O43525 1/20 0.34
KCNQ2 O43526 1/20 0.34
TLR8 Q9NR97 1/20 0.34
PTGER2 P43116 1/20 0.34

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
SCHEMBL4614583 1.00 PPARG (0.46) PPARGPPARDPPARAPTGER4KCNQ3
SCHEMBL4616961 0.94 PPARG (0.51) PPARGPPARDPPARAPTGER4KCNQ3
SCHEMBL4616957 0.94 PPARG (0.51) PPARGPPARDPPARAPTGER4KCNQ3
SCHEMBL4616316 0.93 PPARG (0.53) PPARGPPARDPPARA
SCHEMBL4616312 0.93 PPARG (0.53) PPARGPPARDPPARA
SCHEMBL4614843 0.91 PPARG (0.45) PPARGPPARDPPARAKCNQ3KCNQ2
SCHEMBL4614848 0.91 PPARG (0.45) PPARGPPARDPPARAKCNQ3KCNQ2
SCHEMBL4614528 0.86 PPARG (0.61) PPARGPPARDPPARA
SCHEMBL4614535 0.86 PPARG (0.61) PPARGPPARDPPARA
SCHEMBL4615618 0.86 PPARG (0.54) PPARGPPARDPPARA

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
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
EP-1697304-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2006-09-06 EP disclosed
WO-2005054176-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-16 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-20070082907-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARG 1/4885PPARD 3/4885PPARA 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.