SCHEMBL6506557

SCHEMBL6506557

CCCON=C(C)C(Cc1ccc(OCCc2ccc(CC)cn2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.61
PPARA Q07869 17/20 0.61
CYP3A4 P08684 1/20 0.46
RXRA P19793 1/20 0.46

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
SCHEMBL6508015 1.00 PPARG (0.61) PPARGPPARACYP3A4RXRA
SCHEMBL4874828 0.81 PPARG (0.58) PPARGPPARACYP3A4RXRA
Hydrochloric Acid SCHEMBL5738405 0.80 PPARG (0.57) PPARGPPARACYP3A4RXRA
SCHEMBL6507507 0.79 PPARG (0.63) PPARGPPARA
SCHEMBL6507504 0.79 PPARG (0.63) PPARGPPARA
SCHEMBL6505630 0.79 PPARG (0.61) PPARGPPARA
SCHEMBL6506097 0.79 PPARG (0.61) PPARGPPARA
SCHEMBL3313236 0.79 PPARG (0.58) PPARGPPARACYP3A4RXRA
SCHEMBL13742843 0.77 PPARG (0.54) PPARGPPARACYP3A4RXRA
SCHEMBL5738702 0.77 PPARG (0.65) PPARGCYP3A4RXRA

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