Sugi Predict

Sugi Predict / Compounds / SCHEMBL6533025

SCHEMBL6533025

SCHEMBL6533025

CC(=NOCc1ccc(Cl)cc1)C(Cc1ccc(OC(c2ccc(CC(C)C)cc2)c2cn[nH]c2)cc1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 19/20 0.40
▸ PPARA Q07869 19/20 0.40
▸ MAOB P27338 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
SCHEMBL6533725 0.94 PPARG (0.42) PPARGPPARA
SCHEMBL6532718 0.93 PPARG (0.43) PPARGPPARA
SCHEMBL6533257 0.93 ROCK2 (0.34) PPARGPPARAMAOB
SCHEMBL6532609 0.92 PPARG (0.47) PPARGPPARA
SCHEMBL6534151 0.89 PPARG (0.42) PPARGPPARA
SCHEMBL6533825 0.88 PPARG (0.37) PPARGPPARA
SCHEMBL6532684 0.87 PPARG (0.38) PPARGPPARA
SCHEMBL6530351 0.87 PTGS2 (0.38) PPARGPPARA
SCHEMBL6533744 0.86 PPARG (0.44) PPARGPPARA
SCHEMBL6532874 0.85 PPARG (0.40) 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 2 patents. 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 claimed
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