SCHEMBL8767147

SCHEMBL8767147

CCCCCCCCCCS(=O)(=O)NC(=O)c1cnc(OC(=O)NCC(=O)O)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.39
PPARG P37231 7/20 0.39
PTPN1 P18031 1/20 0.39
SMPD1 P17405 4/20 0.39
SCN9A Q15858 3/20 0.37

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
SCHEMBL8766955 1.00 MGLL (0.39) MGLLPPARGPTPN1SMPD1SCN9A
SCHEMBL8767779 0.96 GABRA5 (0.39) MGLLPPARGPTPN1SMPD1SCN9A
SCHEMBL8105616 0.90 PPARG (0.40) MGLLPPARGSMPD1SCN9A
SCHEMBL8099518 0.90 PPARG (0.40) MGLLPPARGSMPD1SCN9A
SCHEMBL8098997 0.89 PPARG (0.45) MGLLPPARGSMPD1
SCHEMBL8103943 0.88 SMPD1 (0.42) PPARGPTPN1SMPD1SCN9A
SCHEMBL8099012 0.88 SMPD1 (0.42) PPARGPTPN1SMPD1SCN9A
SCHEMBL8915786 0.86 EGLN1 (0.42) PTPN1SMPD1
SCHEMBL8915832 0.86 EGLN1 (0.42) PTPN1SMPD1
SCHEMBL8097631 0.86 SMPD1 (0.42) PPARGPTPN1SMPD1SCN9A

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