SCHEMBL9018299

SCHEMBL9018299

CCCC(CCC)OC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCOCC)cc2)cn1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.38
P4HTM Q9NXG6 3/20 0.38
EGFR P00533 2/20 0.37
KMT2A Q03164 2/20 0.36
CA2 P00918 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
EGLN1 Q9GZT9 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL9018283 0.95 KMT2A (0.43) EPHX2KMT2AL3MBTL1HPGDNPC1
SCHEMBL9018397 0.93 P4HTM (0.41) EPHX2P4HTMEGFRKMT2AHPGD
SCHEMBL9018420 0.93 P4HTM (0.39) EPHX2P4HTMEGFRKMT2ACA2
SCHEMBL9018422 0.90 CA2 (0.41) EPHX2P4HTMEGFRKMT2ACA2
SCHEMBL9018041 0.90 P4HTM (0.44) EPHX2P4HTMEGFRKMT2ACA2
SCHEMBL9018307 0.89 EGFR (0.41) EPHX2P4HTMEGFR
SCHEMBL9018310 0.89 RAB9A (0.48) P4HTMKMT2AHPGDNPC1RAB9A
SCHEMBL9018082 0.89 CA2 (0.47) EPHX2P4HTMEGFRKMT2ACA2
SCHEMBL9018370 0.88 KMT2A (0.45) P4HTMEGFRKMT2AL3MBTL1HPGD
SCHEMBL9017994 0.87 EGFR (0.41) EPHX2P4HTMEGFRKMT2ACA2

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