SCHEMBL6504738

SCHEMBL6504738

CC(=NOCc1ccc(F)cc1)C(Cc1ccc(OCc2nc(-c3ccc(C)cc3)no2)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.59
PPARG P37231 9/20 0.58
PPARA Q07869 9/20 0.58
NPC1 O15118 1/20 0.51
CASP3 P42574 1/20 0.51
RAB9A P51151 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
GSTP1 P09211 3/20 0.50

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
SCHEMBL6527752 0.93 FFAR1 (0.54) FFAR1PPARGPPARANPC1CASP3
SCHEMBL6529368 0.92 FFAR1 (0.57) FFAR1PPARGPPARAGSTP1
SCHEMBL6504947 0.92 FFAR1 (0.57) FFAR1PPARGPPARAGSTP1
SCHEMBL6529794 0.90 PPARG (0.59) FFAR1PPARGPPARA
SCHEMBL6528289 0.90 FFAR1 (0.63) FFAR1PPARGPPARANPC1CASP3
SCHEMBL6527202 0.86 FFAR1 (0.61) FFAR1PPARGPPARANPC1CASP3
SCHEMBL6527206 0.86 FFAR1 (0.61) FFAR1PPARGPPARANPC1CASP3
SCHEMBL6531129 0.85 FFAR1 (0.57) FFAR1PPARGPPARAGSTP1
SCHEMBL6531132 0.85 FFAR1 (0.57) FFAR1PPARGPPARAGSTP1
SCHEMBL6530453 0.80 FFAR1 (0.62) FFAR1PPARGPPARANPC1CASP3

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