SCHEMBL7837747

SCHEMBL7837747

CC(CC(=NOCc1ccc(OCc2csc(-c3ccccc3)n2)cc1)c1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.47
PPARG P37231 4/20 0.47
ALDH1A1 P00352 3/20 0.45
RAB9A P51151 6/20 0.43
MAPT P10636 2/20 0.43
ALOX5 P09917 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
NPC1 O15118 4/20 0.43
TSHR P16473 2/20 0.43
TP53 P04637 2/20 0.43
NFKB1 P19838 2/20 0.43
NFKB2 Q00653 2/20 0.43
RELA Q04206 2/20 0.43
PKM P14618 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL6156692 0.85 PPARA (0.61) PPARAPPARGALDH1A1RAB9AMAPT
SCHEMBL6156688 0.85 PPARA (0.61) PPARAPPARGALDH1A1RAB9AMAPT
SCHEMBL7830888 0.85 PPARA (0.61) PPARAPPARGALDH1A1RAB9AMAPT
SCHEMBL7834380 0.85 PPARA (0.47) PPARAPPARGMAPTALOX5KDM4E
SCHEMBL6157075 0.84 PPARA (0.54) PPARAPPARGALDH1A1RAB9AMAPT
SCHEMBL6157068 0.84 PPARA (0.54) PPARAPPARGALDH1A1RAB9AMAPT
SCHEMBL7822407 0.83 MAOB (0.49) PPARAPPARGALDH1A1RAB9AMAPT
SCHEMBL7834925 0.83 PPARG (0.53) PPARAPPARGALOX5
SCHEMBL7834947 0.83 PPARA (0.60) PPARAPPARGALOX5
SCHEMBL7834483 0.81 ALOX5 (0.66) ALOX5

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
EP-1077957-A1 OXYIMINOALKANOIC ACID DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 2001-02-28 EP disclosed
WO-1999058510-A1 OXYIMINOALKANOIC ACID DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-18 WO disclosed