SCHEMBL7567283

SCHEMBL7567283

COc1ccc(-c2ccc(NS(=O)(=O)c3cccc(C(F)(F)F)c3)c(NS(=O)(=O)c3cccc(C(F)(F)F)c3)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.62
PLAT P00750 1/20 0.62
ACLY P53396 1/20 0.59
SLC20A2 Q08357 1/20 0.56
SLC20A1 Q8WUM9 1/20 0.56
NR3C1 P04150 1/20 0.53
PGR P06401 1/20 0.53
AR P10275 1/20 0.53
ESR2 Q92731 1/20 0.53
IDH2 P48735 1/20 0.52
KEAP1 Q14145 2/20 0.51
NFE2L2 Q16236 2/20 0.51
AXL P30530 1/20 0.51
USP2 O75604 1/20 0.51
USP8 P40818 1/20 0.51
GAA P10253 2/20 0.50
KMT2A Q03164 2/20 0.50
PTGES2 Q9H7Z7 2/20 0.50
MEN1 O00255 1/20 0.50
CCR2 P41597 1/20 0.48

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
SCHEMBL7572438 0.90 SLC20A2 (0.63) PLAUPLATSLC20A2SLC20A1NR3C1
SCHEMBL7568102 0.88 PTPN2 (0.52) PLAUPLATACLYSLC20A2SLC20A1
SCHEMBL7573002 0.88 ACLY (0.59) PLAUPLATACLYSLC20A2SLC20A1
SCHEMBL7566650 0.86 ACLY (0.57) PLAUPLATACLYNR3C1PGR
SCHEMBL7578393 0.85 SLC20A2 (0.64) PLAUPLATSLC20A2SLC20A1NR3C1
SCHEMBL7596158 0.84 ACLY (0.59) PLAUPLATACLYNR3C1PGR
SCHEMBL30110890 0.81 ACLY (0.51) PLAUPLATACLYSLC20A2SLC20A1
SCHEMBL6380677 0.80 SLC20A2 (0.71) PLAUPLATACLYSLC20A2SLC20A1
SCHEMBL7573750 0.79 ACLY (0.56) ACLYNR3C1PGRARESR2
SCHEMBL12201483 0.79 SLC20A2 (0.72) PLAUPLATACLYSLC20A2SLC20A1

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-2002083629-A1 BISSULFONAMIDE DERIVATIVES AS INHIBITORS OF DEHYDROQUINATE SYNTHETASES AND TYPE II DEHYDROQUINASES ARROW THERAPEUTICS LIMITED (GB) 2002-10-24 WO disclosed