SCHEMBL8766943

SCHEMBL8766943

COc1cc(C(=O)NS(=O)(=O)c2ccccc2)cnc1OC(=O)NCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.48
PTGS1 P23219 1/20 0.48
P4HTM Q9NXG6 4/20 0.46
EGFR P00533 1/20 0.44
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
MCL1 Q07820 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
SCN9A Q15858 1/20 0.40
ALKBH2 Q6NS38 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
FTO Q9C0B1 1/20 0.39
PTGER4 P35408 2/20 0.39
TSHR P16473 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
SCHEMBL8104048 0.90 PTGS2 (0.44) PTGS2PTGS1P4HTMEGFRGAA
SCHEMBL8767162 0.87 LMNA (0.40) PTGS2PTGS1P4HTMEGFRSCN9A
SCHEMBL8767458 0.86 P4HTM (0.48) P4HTMSCN9APTGER4
SCHEMBL8767487 0.86 PTGS2 (0.55) PTGS2PTGS1P4HTMEGFRGAA
SCHEMBL8768258 0.86 CA1 (0.39) PTGS2PTGS1P4HTMEGFRSCN9A
Hydrochloric Acid SCHEMBL9231980 0.85 PTGS2 (0.54) PTGS2PTGS1P4HTMEGFRGAA
SCHEMBL9233289 0.85 PTGS2 (0.54) PTGS2PTGS1P4HTMEGFRGAA
SCHEMBL8768360 0.85 L3MBTL1 (0.50) TDP1CYSLTR1TSHR
SCHEMBL8099332 0.85 MEN1 (0.41) PTGS2PTGS1P4HTMEGFRMCL1
SCHEMBL8915935 0.85 PTGS2 (0.51) PTGS2PTGS1P4HTMEGFRGAA

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-0673931-B1 Sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AG (DE) 1997-08-13 EP disclosed
EP-0673931-A1 Sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-27 EP disclosed