SCHEMBL5708239

SCHEMBL5708239

CC(Sc1ccc(OC(C)(C)C(=O)O)cc1)c1cccc2cn(-c3ccc(C(F)(F)F)cc3)nc12

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.43
PPARD Q03181 14/20 0.43
PARP1 P09874 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
PARP3 Q9Y6F1 1/20 0.38
PPARG P37231 6/20 0.37
ADORA3 P0DMS8 1/20 0.36

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
SCHEMBL13791664 0.88 PPARD (0.46) PPARAPPARDPPARG
SCHEMBL3965123 0.87 PPARA (0.43) PPARAPPARDPARP1PARP2PARP3
SCHEMBL5708204 0.87 PPARA (0.45) PPARAPPARDPARP1PARP2PARP3
SCHEMBL13791112 0.86 PPARA (0.41) PPARAPPARDPPARGADORA3
SCHEMBL3960956 0.83 GCG (0.39) PPARAPPARDPARP1PARP2PARP3
SCHEMBL3960605 0.82 PPARA (0.46) PPARAPPARDPARP1PARP2PARP3
SCHEMBL5708233 0.81 PPARA (0.41) PPARAPPARDPPARG
SCHEMBL5708244 0.81 PPARA (0.41) PPARAPPARDPPARG
SCHEMBL3961082 0.80 PPARA (0.45) PPARAPPARDPARP1PARP2PARP3
SCHEMBL5708198 0.80 PPARD (0.48) PPARAPPARDPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1706386-A1 BICYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-10-04 EP claimed
WO-2005066136-A1 BICYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-07-21 WO claimed
US-7544707-B2 Bicyclic derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2009-06-09 US disclosed
US-7544707-B2 Bicyclic derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2009-06-09 US disclosed
US-20070106081-A1 Bicyclic derivatives as ppar modulators ELI LILLY AND COMPANY 2007-05-10 US disclosed
US-20070106081-A1 Bicyclic derivatives as ppar modulators ELI LILLY AND COMPANY 2007-05-10 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-20070106081-A1 Bicyclic derivatives as ppar modulators PPARD, PPARA, PPARG PPARA 2/4885PPARD 1/4885PARP1 3140/4885

“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.