SCHEMBL9018249

SCHEMBL9018249

CCOC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCc3cccc(OC)c3)cc2)cn1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
CA7 P43166 3/20 0.57
CA9 Q16790 3/20 0.57
CA14 Q9ULX7 3/20 0.57
RAB9A P51151 3/20 0.49
ROCK2 O75116 1/20 0.44
ROCK1 Q13464 1/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
P4HTM Q9NXG6 1/20 0.43
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
AKR1C3 P42330 2/20 0.42
AKR1C2 P52895 1/20 0.42
LMNA P02545 1/20 0.42
NAMPT P43490 1/20 0.42

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
SCHEMBL9018237 0.92 CA1 (0.55) CA1CA2CA7CA9CA14
SCHEMBL9018260 0.91 KMT2A (0.54) RAB9AMAPTMEN1KMT2AP4HTM
SCHEMBL9018429 0.90 NPC1 (0.51) CA1CA2CA7CA9CA14
SCHEMBL9018146 0.90 CA1 (0.56) CA1CA2CA7CA9CA14
SCHEMBL9018427 0.88 CA1 (0.53) CA1CA2CA7CA9CA14
SCHEMBL9018023 0.88 CA1 (0.49) CA1CA2CA7CA9CA14
SCHEMBL9018251 0.87 MAPT (0.49) RAB9AMAPTMEN1KMT2AP4HTM
SCHEMBL9139210 0.87 CA1 (0.58) CA1CA2CA7CA9CA14
SCHEMBL9018133 0.87 CA1 (0.54) CA1CA2CA7CA9CA14
SCHEMBL9018352 0.86 CA1 (0.52) CA1CA2CA7CA9CA14

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