SCHEMBL9018050

SCHEMBL9018050

CCOC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCOC)cc2)cn1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.44
GABRA5 P31644 2/20 0.43
EGFR P00533 2/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
HPGD P15428 3/20 0.40
TP53 P04637 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
USP2 O75604 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
EPHX2 P34913 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
SCHEMBL9017994 0.93 EGFR (0.41) P4HTMEGFRKMT2AHPGDKDM4E
SCHEMBL9018337 0.90 ALDH1A1 (0.45) P4HTMEGFRKMT2ATP53KDM4E
SCHEMBL9018017 0.90 EGFR (0.45) P4HTMGABRA5EGFRKMT2AMEN1
SCHEMBL9018048 0.90 NPC1 (0.52) P4HTMKMT2AMEN1HPGD
SCHEMBL9018266 0.90 HPGD (0.47) P4HTMEGFRKMT2AMEN1HPGD
SCHEMBL9018169 0.89 CA2 (0.50) P4HTMEGFRTP53KDM4EALDH1A1
SCHEMBL9018041 0.88 P4HTM (0.44) P4HTMEGFRKMT2AMEN1HPGD
SCHEMBL7867912 0.88 EGFR (0.47) P4HTMGABRA5EGFRKMT2AMEN1
SCHEMBL9018429 0.88 NPC1 (0.51) P4HTMKMT2AMEN1TP53KDM4E
SCHEMBL9018202 0.87 P4HTM (0.43) P4HTMGABRA5EGFRKMT2AMEN1

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