SCHEMBL9518099

SCHEMBL9518099

CC(C)C(=O)OCc1ccc(C(=O)NS(=O)(=O)c2cccc3ccccc23)cn1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 3/20 0.60
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MCL1 Q07820 1/20 0.39
SLC16A3 O15427 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
KCNA5 P22460 2/20 0.37
EDNRA P25101 1/20 0.37
CASP1 P29466 1/20 0.37
HCRTR1 O43613 1/20 0.37
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
PIN1 Q13526 1/20 0.36
HDAC3 O15379 1/20 0.36
HTR6 P50406 1/20 0.36

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
SCHEMBL9519444 0.90 P4HTM (0.62) P4HTMTSHRMEN1NPC1RAB9A
SCHEMBL9516257 0.88 P4HTM (0.64) P4HTMTSHRMEN1NPC1RAB9A
SCHEMBL9517336 0.87 P4HTM (0.44) P4HTMTSHRMEN1KMT2ACYSLTR1
SCHEMBL9517023 0.86 P4HTM (0.62) P4HTMTSHRMEN1NPC1RAB9A
SCHEMBL9519091 0.84 P4HTM (0.42) P4HTMMCL1CASP1HDAC3
SCHEMBL9516016 0.83 P4HTM (0.58) P4HTMMCL1
SCHEMBL9517968 0.83 P4HTM (0.69) P4HTMTSHRMEN1NPC1RAB9A
SCHEMBL9141420 0.78 P4HTM (0.72) P4HTMTSHRNPC1RAB9AMCL1
SCHEMBL9141396 0.78 P4HTM (0.71) P4HTMTSHRNPC1MCL1
SCHEMBL9018333 0.77 P4HTM (0.64) P4HTMTSHRMEN1KMT2AMCL1

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
EP-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed