SCHEMBL9018571

SCHEMBL9018571

CC(C)OC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccccc2-c2ccccc2)cn1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ P4HTM Q9NXG6 5/20 0.42
▸ GABRA5 P31644 7/20 0.39
▸ GRN P28799 1/20 0.38
▸ SORT1 Q99523 1/20 0.38
▸ PDCD1 Q15116 1/20 0.38
▸ CD274 Q9NZQ7 1/20 0.38
▸ CASP1 P29466 2/20 0.38

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
SCHEMBL9018103 0.92 P4HTM (0.45) P4HTMGABRA5GRNSORT1CASP1
SCHEMBL9018334 0.85 P4HTM (0.58) P4HTM
SCHEMBL9139287 0.85 P4HTM (0.52) P4HTMPDCD1CD274CASP1
SCHEMBL9018452 0.80 MCL1 (0.55) P4HTM
SCHEMBL7869169 0.80 GABRA5 (0.44) P4HTMGABRA5
SCHEMBL9018262 0.79 SMN1; SMN2 (0.52) P4HTM
SCHEMBL9018035 0.78 P4HTM (0.58) P4HTMGABRA5
SCHEMBL9018410 0.78 P4HTM (0.47) P4HTMGABRA5
SCHEMBL9018143 0.77 SCN3A (0.48) P4HTM
SCHEMBL9142936 0.77 P4HTM (0.55) P4HTM

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
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