SCHEMBL9516977

SCHEMBL9516977

O=C(NS(=O)(=O)CC(O)c1ccc(Cl)cc1)c1ccc(CO)nc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.44
P4HTM Q9NXG6 5/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
PTGS1 P23219 3/20 0.36
PTGS2 P35354 3/20 0.36
MAP4K4 O95819 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HDAC3 O15379 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
HTT P42858 1/20 0.34
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL9515755 0.91 EGFR (0.39) EGFRP4HTMFLT1FLT4KDR
SCHEMBL9519674 0.89 EGFR (0.43) EGFRP4HTMFLT1FLT4KDR
SCHEMBL9518022 0.89 HDAC6 (0.39) P4HTMPTGS1PTGS2MEN1NPC1
SCHEMBL9515897 0.88 EGFR (0.42) EGFRP4HTMFLT1FLT4KDR
SCHEMBL9517265 0.86 EGFR (0.41) EGFRP4HTMFLT1FLT4KDR
SCHEMBL9515773 0.86 HSD11B1 (0.43) P4HTMPTGS1HDAC3HDAC1HDAC2
SCHEMBL9517939 0.85 EGFR (0.40) EGFRP4HTMNPC1RAB9AHTT
SCHEMBL9516886 0.83 MMP1 (0.40) NPC1RAB9AKMT2A
SCHEMBL9515738 0.83 P4HTM (0.43) EGFRP4HTMMEN1NPC1RAB9A
SCHEMBL9517030 0.81 SLC6A9 (0.39) P4HTMMEN1NPC1RAB9AKMT2A

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