SCHEMBL6533320

SCHEMBL6533320

CCCON=C(C)C(C)(Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)cc1)C(=O)O.CON=C(C)C(C)(Cc1ccc(OCCc2nc(-c3cccs3)oc2C)cc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.60
PPARG P37231 19/20 0.60
PPARD Q03181 11/20 0.60

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
SCHEMBL6533315 1.00 PPARA (0.60) PPARAPPARGPPARD
SCHEMBL6533322 0.95 PPARA (0.58) PPARAPPARGPPARD
SCHEMBL6508467 0.90 PPARA (0.68) PPARAPPARGPPARD
SCHEMBL6507805 0.88 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL6511848 0.84 PPARA (0.68) PPARAPPARGPPARD
SCHEMBL7903440 0.79 PPARA (0.78) PPARAPPARGPPARD
SCHEMBL14528848 0.77 PPARA (0.75) PPARAPPARGPPARD
SCHEMBL6384145 0.77 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL7904686 0.76 PPARA (0.72) PPARAPPARGPPARD
Ly-510929 SCHEMBL362615 0.76 PPARA (1.00) PPARAPPARGPPARD

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