SCHEMBL6534150

SCHEMBL6534150

C/C(=N\OCc1ccc(C)cc1)C(Cc1ccc(OCc2cnn(-c3ccc(C)cc3)c2)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.47
PPARA Q07869 18/20 0.47
MAOB P27338 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
SCHEMBL6534152 1.00 PPARG (0.47) PPARGPPARAMAOB
SCHEMBL6533743 0.97 PPARG (0.48) PPARGPPARA
SCHEMBL6533745 0.97 PPARG (0.48) PPARGPPARA
SCHEMBL6532813 0.96 PPARG (0.53) PPARGPPARA
SCHEMBL6532807 0.96 PPARG (0.53) PPARGPPARA
SCHEMBL6533884 0.92 PPARG (0.39) PPARGPPARAMAOB
SCHEMBL6533887 0.92 PPARG (0.39) PPARGPPARAMAOB
SCHEMBL6533980 0.92 PPARG (0.56) PPARGPPARA
SCHEMBL6533977 0.92 PPARG (0.56) PPARGPPARA
SCHEMBL6532376 0.91 LTA4H (0.43) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005040127-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2005-05-06 WO disclosed