SCHEMBL9018027

SCHEMBL9018027

CCCCCCNC(=O)c1ccc(S(=O)(=O)NC(=O)c2ccc(OC(=O)OC)nc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.46
NAAA Q02083 2/20 0.45
P4HTM Q9NXG6 2/20 0.44
MLYCD O95822 1/20 0.42
EGFR P00533 2/20 0.42
HSD17B10 Q99714 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 3/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
LMNA P02545 1/20 0.40
ALB P02768 1/20 0.40
CYP2C9 P11712 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL9018436 0.96 CA2 (0.46) CA2L3MBTL1P4HTMEGFRALDH1A1
SCHEMBL9018392 0.93 CA2 (0.48) CA2L3MBTL1NAAAP4HTMMLYCD
SCHEMBL9018169 0.92 CA2 (0.50) CA2L3MBTL1NAAAP4HTMMLYCD
SCHEMBL9018087 0.92 CA2 (0.47) CA2L3MBTL1NAAAP4HTMMLYCD
SCHEMBL9018082 0.91 CA2 (0.47) CA2L3MBTL1NAAAP4HTMMLYCD
SCHEMBL9018042 0.90 SMN1; SMN2 (0.43) CA2L3MBTL1NAAAP4HTMLMNA
SCHEMBL7862801 0.89 CA2 (0.48) CA2L3MBTL1NAAAP4HTMMLYCD
SCHEMBL9018404 0.89 EGLN1 (0.45) CA2P4HTMEGFRNPC1RAB9A
SCHEMBL9018236 0.89 HPGD (0.50) L3MBTL1P4HTMEGFRNPC1RAB9A
SCHEMBL9018337 0.88 ALDH1A1 (0.45) CA2L3MBTL1P4HTMEGFRNPC1

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