SCHEMBL9018053

SCHEMBL9018053

CCCCCCNC(=O)c1cccc(S(=O)(=O)NC(=O)c2ccc(OC(=O)OC(CC)CC)nc2)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NAAA Q02083 1/20 0.39
KMT2A Q03164 2/20 0.38
FBP1 P09467 5/20 0.38
RXFP1 Q9HBX9 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MCL1 Q07820 1/20 0.38
P4HTM Q9NXG6 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CASP3 P42574 1/20 0.36
MEN1 O00255 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
SMPD1 P17405 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
SCHEMBL9018075 0.97 SMN1; SMN2 (0.43) SMN1; SMN2KMT2AFBP1RXFP1BCL2L1
SCHEMBL9018126 0.93 SMN1; SMN2 (0.40) CA2SMN1; SMN2NAAAKMT2AFBP1
SCHEMBL9018042 0.92 SMN1; SMN2 (0.43) CA2SMN1; SMN2NAAAKMT2AFBP1
SCHEMBL9018286 0.92 GABRA5 (0.40) SMN1; SMN2KMT2AP4HTMCASP3MEN1
SCHEMBL9018093 0.91 ALDH1A1 (0.42) SMN1; SMN2P4HTML3MBTL1HDAC6
SCHEMBL9018087 0.91 CA2 (0.47) CA2SMN1; SMN2NAAAKMT2ARXFP1
SCHEMBL9018378 0.90 RAB9A (0.43) SMN1; SMN2P4HTMHDAC6
SCHEMBL9018177 0.90 RAB9A (0.40) SMN1; SMN2KMT2AFBP1L3MBTL1CASP3
SCHEMBL9018331 0.90 RAB9A (0.40) SMN1; SMN2KMT2AP4HTMCASP3MEN1
SCHEMBL9018055 0.90 SMN1; SMN2 (0.42) SMN1; SMN2KMT2ABCL2L1MCL1P4HTM

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