SCHEMBL4793243

SCHEMBL4793243

Cc1cc(SC(c2ccc(C(F)(F)F)cc2)c2n[nH]c3ccc(OC(F)(F)F)cc23)ccc1OCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.52
PPARA Q07869 2/20 0.49

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
SCHEMBL4793068 0.93 PPARD (0.53) PPARD
SCHEMBL4795399 0.91 PPARD (0.55) PPARDPPARA
SCHEMBL4794155 0.91 PPARD (0.42) PPARDPPARA
SCHEMBL4795066 0.90 PPARD (0.53) PPARDPPARA
SCHEMBL4792791 0.88 PPARD (0.51) PPARD
SCHEMBL4794224 0.88 PPARD (0.59) PPARDPPARA
SCHEMBL4792694 0.84 PPARD (0.53) PPARDPPARA
SCHEMBL4794264 0.82 PPARD (0.44) PPARDPPARA
SCHEMBL4792923 0.82 PPARD (0.50) PPARD
SCHEMBL4795340 0.82 PPARD (0.55) PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937647-A1 CONDENSED PYRAZOLE DERIVATIVES AS PPAR AGONISTS II Inpharmatica Limited (GB) 2008-07-02 EP disclosed
WO-2007036727-A1 CONDENSED PYRAZOLE DERIVATIVES AS PPAR AGONISTS II INPHARMATICA LIMITED (GB) 2007-04-05 WO disclosed