SCHEMBL9018092

SCHEMBL9018092

CCCCNC(=O)c1cccc(S(=O)(=O)NC(=O)c2ccc(OC(=O)OC)nc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
FBP1 P09467 1/20 0.44
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.41
MAPT P10636 3/20 0.41
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
HTT P42858 1/20 0.41
P4HTM Q9NXG6 3/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
PTGDR Q13258 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
CASP3 P42574 1/20 0.40
ALDH1A1 P00352 2/20 0.39
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL9018042 0.96 SMN1; SMN2 (0.43) SMN1; SMN2FBP1KMT2AMEN1MAPT
SCHEMBL9018325 0.93 SMN1; SMN2 (0.44) SMN1; SMN2FBP1KMT2AMEN1MAPT
SCHEMBL9018269 0.93 GABRA5 (0.44) SMN1; SMN2KMT2AMEN1MAPTLMNA
SCHEMBL9018075 0.92 SMN1; SMN2 (0.43) SMN1; SMN2FBP1KMT2AMEN1MAPT
SCHEMBL9018213 0.92 SMN1; SMN2 (0.45) SMN1; SMN2FBP1KMT2AMEN1MAPT
SCHEMBL9018327 0.91 HPGD (0.44) SMN1; SMN2FBP1KMT2AMEN1MAPT
SCHEMBL9018118 0.91 RAB9A (0.44) SMN1; SMN2KMT2AMEN1MAPTLMNA
SCHEMBL9018408 0.91 SMN1; SMN2 (0.46) SMN1; SMN2KMT2AMEN1MAPTBCL2L1
SCHEMBL9018085 0.90 RAB9A (0.47) SMN1; SMN2HTTP4HTMALDH1A1RAB9A
SCHEMBL9018126 0.90 SMN1; SMN2 (0.40) SMN1; SMN2FBP1KMT2AMEN1MAPT

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