SCHEMBL7572994

SCHEMBL7572994

O=S(=O)(Nc1cc2ccccc2cc1NS(=O)(=O)c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.66
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
GAA P10253 2/20 0.65
NR3C1 P04150 1/20 0.61
PGR P06401 1/20 0.61
AR P10275 1/20 0.61
ESR2 Q92731 1/20 0.61
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
MMP1 P03956 1/20 0.60
MMP2 P08253 1/20 0.60
MMP9 P14780 1/20 0.60
MMP8 P22894 1/20 0.60
MMP13 P45452 1/20 0.60
LMNA P02545 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
CCR2 P41597 1/20 0.58
ACLY P53396 1/20 0.58
CLK1 P49759 1/20 0.57

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
SCHEMBL7592771 0.89 MEN1 (0.74) SLC40A1MEN1KMT2AGAANR3C1
SCHEMBL7572582 0.87 CLK1 (0.67) SLC40A1MEN1KMT2AGAANR3C1
SCHEMBL7594309 0.86 KMT2A (0.63) SLC40A1MEN1KMT2AGAANR3C1
SCHEMBL7591899 0.85 KMT2A (0.61) SLC40A1MEN1KMT2AGAANR3C1
SCHEMBL7598878 0.84 PTGES2 (0.62) SLC40A1MEN1KMT2AGAAAR
SCHEMBL7572596 0.84 MEN1 (0.67) SLC40A1MEN1KMT2AGAANR3C1
SCHEMBL10143421 0.82 MEN1 (0.66) SLC40A1MEN1KMT2AGAANR3C1
SCHEMBL10622385 0.82 MEN1 (0.66) SLC40A1MEN1KMT2AGAANR3C1
SCHEMBL3762909 0.81 PGR (0.77) MEN1KMT2AGAANR3C1PGR
SCHEMBL7568254 0.81 MEN1 (0.57) SLC40A1MEN1KMT2AGAANR3C1

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