SCHEMBL9018340

SCHEMBL9018340

COCCOC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(CCNC(=O)c3ccc(F)cc3)cc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
BCL2L1 Q07817 1/20 0.44
MCL1 Q07820 1/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
EPHX2 P34913 2/20 0.44
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GABRA5 P31644 1/20 0.43
HTT P42858 1/20 0.42
PTGS2 P35354 2/20 0.42
MCHR1 Q99705 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL9018181 0.93 MAPT (0.54) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9018049 0.93 MAPT (0.54) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9018324 0.92 MAPT (0.54) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9018414 0.92 MAPT (0.54) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9018552 0.90 MAPT (0.49) MAPTMEN1KMT2ACA12CA1
SCHEMBL7874555 0.90 MAPT (0.51) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9018557 0.88 MAPT (0.51) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9018107 0.88 MAPT (0.51) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9141753 0.87 MAPT (0.52) MAPTMEN1KMT2ABCL2L1MCL1
SCHEMBL9018061 0.86 MAPT (0.49) MAPTMEN1KMT2ABCL2L1MCL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0590520-B1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AG (DE) 1996-06-12 EP disclosed
EP-0590520-A1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-06 EP disclosed