SCHEMBL7565044

SCHEMBL7565044

Nc1cc(Br)ccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
GAA P10253 1/20 0.54
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
MMP1 P03956 1/20 0.52
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MMP8 P22894 1/20 0.52
MMP13 P45452 1/20 0.52
LMNA P02545 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
SLC40A1 Q9NP59 1/20 0.52
CLK1 P49759 1/20 0.51
PTGES2 Q9H7Z7 1/20 0.51
CCR2 P41597 1/20 0.49
ACLY P53396 1/20 0.49
TSHR P16473 1/20 0.49
NR3C1 P04150 1/20 0.48
PGR P06401 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
SCHEMBL7568254 0.88 MEN1 (0.57) MEN1KMT2AGAACA1CA2
SCHEMBL17340529 0.85 CCR2 (0.55) MEN1KMT2AGAACA1CA2
SCHEMBL29666321 0.83 MEN1 (0.55) MEN1KMT2AGAACA1CA2
SCHEMBL18302531 0.83 MEN1 (0.55) MEN1KMT2AGAACA1CA2
SCHEMBL7591899 0.81 KMT2A (0.61) MEN1KMT2AGAACA1CA2
SCHEMBL7568328 0.81 GAA (0.50) MEN1KMT2AGAACA1CA2
SCHEMBL1138972 0.80 MEN1 (0.57) MEN1KMT2AGAALMNAPTGES2
SCHEMBL7592771 0.79 MEN1 (0.74) MEN1KMT2AGAACA1CA2
SCHEMBL19065106 0.79 TSHR (0.64) MEN1KMT2AGAACA1CA2
SCHEMBL7577554 0.78 MEN1 (0.55) MEN1KMT2AGAACA1CA2

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