SCHEMBL9018325

SCHEMBL9018325

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

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
FBP1 P09467 1/20 0.42
EGLN1 Q9GZT9 1/20 0.42
KMT2A Q03164 5/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 3/20 0.39
BCL2L1 Q07817 1/20 0.39
MCL1 Q07820 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
P4HTM Q9NXG6 3/20 0.39
PTGDR Q13258 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
HPGD P15428 1/20 0.38
CASP3 P42574 1/20 0.38
PAX8 Q06710 1/20 0.38

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
SCHEMBL9018126 0.97 SMN1; SMN2 (0.40) SMN1; SMN2FBP1EGLN1KMT2ACYP2C9
SCHEMBL9018092 0.93 SMN1; SMN2 (0.47) SMN1; SMN2FBP1KMT2AMEN1BCL2L1
SCHEMBL9018075 0.92 SMN1; SMN2 (0.43) SMN1; SMN2FBP1EGLN1KMT2AMEN1
SCHEMBL9018555 0.92 RAB9A (0.42) SMN1; SMN2FBP1KMT2AMEN1LMNA
SCHEMBL9018526 0.91 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AMEN1BCL2L1MCL1
SCHEMBL9018010 0.91 RAB9A (0.44) SMN1; SMN2HTTP4HTMHPGDPAX8
SCHEMBL9018375 0.90 MEN1 (0.41) SMN1; SMN2KMT2AMEN1LMNAMAPT
SCHEMBL9018404 0.90 EGLN1 (0.45) EGLN1KMT2ACYP2C9CYP2C19LMNA
SCHEMBL9018465 0.90 ALDH1A1 (0.44) SMN1; SMN2CYP2C9CYP2C19MAPTHTT
SCHEMBL9018346 0.90 RAB9A (0.39) SMN1; SMN2FBP1KMT2AMEN1BCL2L1

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