SCHEMBL9515946

SCHEMBL9515946

CCOCc1ccc(C(=O)NS(=O)(=O)C(CC=O)c2ccccc2OCC)cn1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 4/20 0.40
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
AHR P35869 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CASP3 P42574 1/20 0.34
HCRTR1 O43613 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MAPT P10636 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL9519297 0.88 P4HTM (0.42) P4HTMPOLBKDM4EALDH1A1GAA
SCHEMBL9515435 0.81 P4HTM (0.40) P4HTMPOLBKDM4EALDH1A1GAA
SCHEMBL9519306 0.80 P4HTM (0.42) P4HTMPOLBKDM4EALDH1A1GAA
SCHEMBL9517214 0.80 SMN1; SMN2 (0.36) P4HTMGAAKMT2AMAPTHSD17B10
SCHEMBL9516269 0.80 P4HTM (0.40) P4HTMPOLBKDM4EALDH1A1GAA
SCHEMBL9517204 0.79 P4HTM (0.43) P4HTMPOLBKDM4EALDH1A1GAA
SCHEMBL9519746 0.79 P4HTM (0.40) P4HTMPOLBKDM4EALDH1A1GAA
SCHEMBL9515952 0.79 P4HTM (0.41) P4HTMPOLBKDM4EALDH1A1GAA
SCHEMBL9517908 0.75 CXCR1 (0.39) P4HTMCASP3
SCHEMBL9516321 0.74 LMNA (0.39) P4HTMPOLBKDM4ECASP3NPC1

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