SCHEMBL5737571

SCHEMBL5737571

Nc1ccc(S(=O)(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1Cl

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 14/20 0.67
CA2 P00918 14/20 0.67
CA9 Q16790 6/20 0.67
CA12 O43570 4/20 0.67
CA4 P22748 1/20 0.67
CA6 P23280 1/20 0.67
CA5A P35218 1/20 0.67
CA7 P43166 1/20 0.67
CA14 Q9ULX7 1/20 0.67
CA5B Q9Y2D0 1/20 0.67
HTT P42858 1/20 0.61
MAPT P10636 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
CES1 P23141 1/20 0.50
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
PKM P14618 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL5225275 0.89 CES1 (0.66) CA1CA2CA9CA12CA4
SCHEMBL10692669 0.86 MAPT (0.57) CA1CA2CA9CA12CA4
SCHEMBL10693412 0.86 KMT2A (0.60) CA1CA2CA9CA12CA4
SCHEMBL5737935 0.84 MAPT (0.62) CA1CA2CA9CA12CA4
SCHEMBL5737038 0.82 PGR (0.63) MAPTMEN1LMNAPKMKMT2A
SCHEMBL248783 0.81 CA1 (1.00) CA1CA2CA9CA12CA4
SCHEMBL29906360 0.81 CA1 (1.00) CA1CA2CA9CA12CA4
SCHEMBL23109373 0.81 PKM (0.62) MAPTNPSR1MEN1LMNAPKM
SCHEMBL11085201 0.79 PRMT1 (0.60) CA1CA2CA9HTTMAPT
SCHEMBL5737651 0.79 ALDH1A1 (0.62) HTTMAPTNPSR1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1064274-B1 BENZENESULFONAMIDE DERIVATIVES AND THEIR USE AS MEDICAMENTS ASTRAZENECA AB (SE) 2006-04-19 EP disclosed
US-6667342-B1 Elevation of pyruvate dehydrogenase activity ASTRAZENECA AB (SE) 2003-12-23 US disclosed
EP-1064274-A1 BENZENESULFONAMIDE DERIVATIVES AND THEIR USE AS MEDICAMENTS AstraZeneca AB (SE) 2001-01-03 EP disclosed
WO-1999047508-A1 BENZENESULFONAMIDE-DERIVATIVES AND THEIR USE AS MEDICAMENTS ASTRAZENECA AB (SE) 1999-09-23 WO disclosed