SCHEMBL9517110

SCHEMBL9517110

O=C(NS(=O)(=O)c1ccccc1)c1ccc(COC(=O)c2ccccc2)nc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 4/20 0.61
PTGS2 P35354 4/20 0.54
PTGS1 P23219 2/20 0.50
BCL2L1 Q07817 4/20 0.46
MCL1 Q07820 4/20 0.46
EGFR P00533 3/20 0.46
CASP3 P42574 1/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
KMT2A Q03164 1/20 0.45
FLT1 P17948 1/20 0.45
FLT4 P35916 1/20 0.45
KDR P35968 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CYP3A4 P08684 1/20 0.43

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
SCHEMBL9519173 0.90 P4HTM (0.58) P4HTMPTGS2BCL2L1MCL1EGFR
SCHEMBL9517241 0.88 P4HTM (0.61) P4HTMPTGS2PTGS1BCL2L1MCL1
SCHEMBL9515933 0.87 P4HTM (0.55) P4HTMPTGS2PTGS1BCL2L1MCL1
SCHEMBL9517975 0.87 P4HTM (0.53) P4HTMCASP3LMNAKMT2AL3MBTL1
SCHEMBL9516016 0.86 P4HTM (0.58) P4HTMPTGS2PTGS1BCL2L1MCL1
SCHEMBL9516962 0.84 LIMK1 (0.48) P4HTMPTGS2BCL2L1MCL1EGFR
SCHEMBL9515532 0.83 P4HTM (0.61) P4HTMPTGS2PTGS1BCL2L1MCL1
SCHEMBL9518145 0.83 P4HTM (0.61) P4HTMPTGS2PTGS1BCL2L1MCL1
SCHEMBL9517200 0.82 P4HTM (0.70) P4HTMPTGS2PTGS1BCL2L1MCL1
SCHEMBL9517040 0.82 MEN1 (0.48) MEN1LMNAKMT2A

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