SCHEMBL8105616

SCHEMBL8105616

CCCCCCCCCCCCCCCCS(=O)(=O)NC(=O)c1cnc(OC(=O)NCC(=O)OCC)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
MGLL Q99685 1/20 0.37
SMPD1 P17405 3/20 0.37
SCN9A Q15858 3/20 0.37
SCN5A Q14524 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL8099518 1.00 PPARG (0.40) PPARGSMN1; SMN2MGLLSMPD1SCN9A
SCHEMBL8090622 0.96 SMN1; SMN2 (0.39) PPARGSMN1; SMN2SCN9ASCN5AMEN1
SCHEMBL8098997 0.94 PPARG (0.45) PPARGMGLLSMPD1MEN1KMT2A
SCHEMBL8766955 0.90 MGLL (0.39) PPARGMGLLSMPD1SCN9A
SCHEMBL8767147 0.90 MGLL (0.39) PPARGMGLLSMPD1SCN9A
SCHEMBL8876183 0.87 SMN1; SMN2 (0.42) PPARGSMN1; SMN2SMPD1MEN1KMT2A
SCHEMBL8875618 0.87 SMN1; SMN2 (0.42) PPARGSMN1; SMN2SMPD1MEN1KMT2A
SCHEMBL8767779 0.86 GABRA5 (0.39) PPARGMGLLSMPD1SCN9ASCN5A
SCHEMBL8099435 0.84 GABRA5 (0.36) PPARGSMN1; SMN2SCN9ASCN5A
SCHEMBL8099012 0.84 SMPD1 (0.42) PPARGSMPD1SCN9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673932-B1 Sulfonamidocarbonyl-pyridine-2-carboxamides as well as their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AG (DE) 2000-06-07 EP disclosed
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
EP-0673932-A1 Sulfonamidocarbonyl-pyridine-2-carboxamides as well as their pyridine-N-oxides, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-27 EP disclosed