SCHEMBL5708243

SCHEMBL5708243

Cc1cc(SC(C)c2cccc3cn(-c4ccc(C(F)(F)F)cc4)nc23)ccc1CCC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 17/20 0.40
PPARA Q07869 5/20 0.40
PPARG P37231 4/20 0.40
PARP1 P09874 1/20 0.38
GCG P01275 1/20 0.36
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL5708221 0.89 PPARD (0.40) PPARDPPARAPPARGPARP1
SCHEMBL5904649 0.87 PPARD (0.43) PPARDPPARAPPARGFFAR1FFAR4
SCHEMBL5904647 0.87 PPARD (0.43) PPARDPPARAPPARGFFAR1FFAR4
SCHEMBL5904700 0.87 PPARD (0.43) PPARDPPARAPPARGFFAR1FFAR4
SCHEMBL3963872 0.85 PPARD (0.51) PPARDPPARA
SCHEMBL5904714 0.85 PPARD (0.40) PPARDPPARAPPARGFFAR1FFAR4
SCHEMBL5904571 0.85 PPARD (0.40) PPARDPPARAPPARGFFAR1FFAR4
SCHEMBL3966899 0.85 PPARD (0.47) PPARDPPARAPPARGPARP1GCG
SCHEMBL3961112 0.84 PPARD (0.41) PPARDPPARAPPARGPARP1FFAR1
SCHEMBL5708246 0.84 PPARD (0.41) PPARDPPARAPPARGPARP1FFAR1

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 PPARD 1/4885PPARA 2/4885PPARG 3/4885

“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.