SCHEMBL6527202

SCHEMBL6527202

CCc1ccc(-c2noc(COc3ccc(CC(C(=O)O)/C(C)=N/OCc4ccccc4)cc3)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.61
PPARG P37231 11/20 0.53
PPARA Q07869 11/20 0.53
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
POLB P06746 2/20 0.47
ADRB2 P07550 2/20 0.47
HPGD P15428 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL6527206 1.00 FFAR1 (0.61) FFAR1PPARGPPARARAB9ANPC1
SCHEMBL6528317 0.93 FFAR1 (0.57) FFAR1PPARGPPARARAB9ANPC1
SCHEMBL6504738 0.86 FFAR1 (0.59) FFAR1PPARGPPARARAB9ANPC1
SCHEMBL6528289 0.86 FFAR1 (0.63) FFAR1PPARGPPARARAB9ANPC1
SCHEMBL6529368 0.85 FFAR1 (0.57) FFAR1PPARGPPARA
SCHEMBL6504947 0.85 FFAR1 (0.57) FFAR1PPARGPPARA
SCHEMBL6529794 0.82 PPARG (0.59) FFAR1PPARGPPARA
SCHEMBL6529240 0.81 PPARG (0.60) FFAR1PPARGPPARARAB9ANPC1
SCHEMBL6527925 0.80 PPARG (0.59) PPARGPPARAMAPT
SCHEMBL6509052 0.80 PPARG (0.59) PPARGPPARAMAPT

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