SCHEMBL22909262

SCHEMBL22909262

CN(C)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1OCc1ccncc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.39
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
NAMPT P43490 1/20 0.36
MAOB P27338 1/20 0.34
RORC P51449 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
NPC1 O15118 2/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
LRRK2 Q5S007 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL29729050 1.00 HDAC6 (0.39) HDAC6ALOX5APFEN1NAMPTMAOB
SCHEMBL22909373 0.86 AR (0.45) HDAC6SMN1; SMN2CA1CA2LMNA
SCHEMBL22909451 0.81 TSHR (0.48) ALOX5APFEN1MAOBNPC1RAB9A
SCHEMBL22909344 0.80 PARP10 (0.48) HDAC6ALOX5APFEN1MAOB
SCHEMBL29671227 0.80 CYP19A1 (0.50) MAOBCA1CA2
SCHEMBL29671271 0.79 SMN1; SMN2 (0.43) MAOBHSD17B10SMN1; SMN2MAPT
SCHEMBL22909370 0.79 SMN1; SMN2 (0.43) MAOBHSD17B10SMN1; SMN2MAPT
SCHEMBL29729048 0.75 CA1 (0.31) HDAC6CA1CA2
SCHEMBL22909160 0.75 MAPT (0.36) HDAC6PKMCA1CA2MAPT
SCHEMBL22909579 0.74 MAOB (0.43) MAOB

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-2021009568-A1 BENZENESULFONAMIDE DERIVATIVES AND USES THEREOF 2692372 ONTARIO, INC. (CA) 2021-01-21 WO disclosed