SCHEMBL7673230

SCHEMBL7673230

CC(=NOCc1ccccc1)c1cccc(CO)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.60
PPARA Q07869 13/20 0.60
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
LMNA P02545 2/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
HPGD P15428 1/20 0.45
S1PR1 P21453 1/20 0.43

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
SCHEMBL7667799 0.87 PPARG (0.59) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL7667801 0.87 PPARG (0.59) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL4451421 0.85 L3MBTL1 (0.71) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL19733323 0.85 L3MBTL1 (0.71) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL10269026 0.84 NPC1 (0.62) PPARGPPARANPC1RAB9AL3MBTL1
Water SCHEMBL4316877 0.84 NPC1 (0.74) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL7670800 0.81 PPARG (0.57) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL7670796 0.81 PPARG (0.57) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL7662436 0.80 PPARG (0.56) PPARGPPARANPC1RAB9AL3MBTL1
SCHEMBL7673299 0.80 PPARG (0.56) PPARGPPARANPC1RAB9AL3MBTL1

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
US-6489487-B1 AGRICULTURAL OR HORTICULTURAL FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-03 US disclosed
EP-1103548-A1 TRIAZOLONE DERIVATIVES, USE THEREOF, AND INTERMEDIATE THEREFOR SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2001-05-30 EP disclosed