SCHEMBL4287192

SCHEMBL4287192

O=C(OCc1cc(=O)[nH]cc1Cl)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TDP1 Q9NUW8 4/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
PPARG P37231 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP12 P39900 1/20 0.45
RAB9A P51151 3/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 2/20 0.41
LMNA P02545 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HIF1A Q16665 1/20 0.41
THRB P10828 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
SCHEMBL5421974 0.76 L3MBTL1 (0.72) MAPK1TDP1SLC6A2SLC6A3KMT2A
SCHEMBL9670389 0.75 KMT2A (0.49) NPSR1TDP1SLC6A2SLC6A3KMT2A
SCHEMBL755285 0.74 L3MBTL1 (0.51) MAPK1NPSR1TDP1SLC6A2SLC6A3
SCHEMBL8230355 0.74 RAB9A (0.51) MAPK1NPSR1TDP1SLC6A2SLC6A3
SCHEMBL6666901 0.74 L3MBTL1 (0.74) TDP1SLC6A2SLC6A3KMT2APPARG
SCHEMBL2291589 0.74 L3MBTL1 (0.57) MAPK1NPSR1TDP1SLC6A2SLC6A3
SCHEMBL4287166 0.73 TDP1 (0.45) MAPK1NPSR1TDP1SLC6A2SLC6A3
SCHEMBL5085480 0.73 PPARG (0.71) MAPK1NPSR1TDP1SLC6A2SLC6A3
SCHEMBL4288496 0.69 TDP1 (0.55) TDP1SLC6A2SLC6A3KMT2APPARG
SCHEMBL28982407 0.69 PPARG (0.61) MAPK1NPSR1TDP1SLC6A2SLC6A3

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-2009158258-A1 HERBICIDAL DIHYDRO OXO SIX-MEMBERED AZINYL ISOXAZOLINES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-12-30 WO disclosed