SCHEMBL9018239

SCHEMBL9018239

CCOCCNC(=O)c1ccc(S(=O)(=O)NC(=O)c2ccc(OC(=O)OC3CCCC3)nc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 2/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CXCR1 P25024 1/20 0.38
CXCR2 P25025 1/20 0.38
EPHX2 P34913 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
P4HTM Q9NXG6 1/20 0.37
GABRA5 P31644 1/20 0.37
EGFR P00533 1/20 0.37

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
SCHEMBL9018002 0.99 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL9018020 0.96 HPGD (0.43) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL9018502 0.92 GABRA5 (0.43) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL9018483 0.91 GABRA5 (0.43) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL9018430 0.90 ACACB (0.40) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL9018131 0.89 HPGD (0.41) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL9018501 0.89 CXCR1 (0.42) MAPTSMN1; SMN2LMNACXCR1CXCR2
SCHEMBL9018120 0.88 CA2 (0.45) MAPTKDM4EHPGDSMN1; SMN2LMNA
SCHEMBL9018041 0.88 P4HTM (0.44) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL9018187 0.87 CA2 (0.45) MAPTKDM4EHPGDSMN1; SMN2LMNA

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