SCHEMBL7577401

SCHEMBL7577401

Cc1c(Cl)cccc1S(=O)(=O)Nc1ccc(C#N)cc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.61
SLC22A12 Q96S37 8/20 0.54
EDNRB P24530 2/20 0.50
EDNRA P25101 2/20 0.50
SLC40A1 Q9NP59 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
KDM1A O60341 1/20 0.46
IDH1 O75874 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46

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
SCHEMBL7578851 0.84 HSD11B1 (0.58) HSD11B1EDNRBEDNRASLC40A1IDH1
SCHEMBL7596336 0.83 HSD11B1 (0.55) HSD11B1SLC22A12EDNRBEDNRASLC40A1
SCHEMBL3768958 0.82 HSD11B1 (0.60) HSD11B1EDNRBEDNRASLC40A1CA1
SCHEMBL29561322 0.82 MAPT (0.60) HSD11B1KDM1A
SCHEMBL95032 0.81 HSD11B1 (0.59) HSD11B1EDNRBEDNRASLC40A1
SCHEMBL7572722 0.81 ALDH1A1 (0.56) HSD11B1EDNRBEDNRASLC40A1IDH1
SCHEMBL2892307 0.80 SLC22A12 (0.63) SLC22A12CA1CA2KDM1AIDH1
SCHEMBL14433960 0.78 HSD17B1 (0.56) SLC22A12CA1CA2KDM1AIDH1
SCHEMBL7591248 0.76 HSD11B1 (0.63) HSD11B1EDNRBEDNRASLC40A1
SCHEMBL20354772 0.76 DYRK1A (0.48) HSD11B1SLC22A12CA1CA2TAS1R3

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
EP-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 WO disclosed