SCHEMBL6151107

SCHEMBL6151107

Cc1cc(C)c(/C=C/Cc2ccsc2S(=O)(=O)Nc2onc(C)c2Br)c(C)c1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 20/20 0.75
EDNRB P24530 19/20 0.75

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
SCHEMBL6151109 1.00 EDNRA (0.75) EDNRAEDNRB
SCHEMBL4632359 0.89 EDNRB (0.79) EDNRAEDNRB
SCHEMBL4632361 0.89 EDNRB (0.79) EDNRAEDNRB
SCHEMBL4631359 0.87 EDNRA (0.74) EDNRAEDNRB
SCHEMBL4631352 0.87 EDNRA (0.74) EDNRAEDNRB
SCHEMBL4632061 0.86 EDNRA (0.69) EDNRAEDNRB
SCHEMBL4632066 0.86 EDNRA (0.69) EDNRAEDNRB
SCHEMBL6151304 0.86 EDNRA (1.00) EDNRAEDNRB
SCHEMBL4632360 0.85 EDNRA (0.66) EDNRAEDNRB
SCHEMBL4632356 0.85 EDNRA (0.66) EDNRAEDNRB

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
US-5962490-A Thienyl-, furyl- and pyrrolyl-sulfonamides and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORPORATION (US) 1999-10-05 US claimed
EP-0980369-B1 SULFONAMIDES FOR TREATMENT OF ENDOTHELIN-MEDIATED DISORDERS ENCYSIVE PHARMACEUTICALS INC (US) 2005-03-30 EP disclosed
EP-1498419-A1 Process for preparing alkali metal salts of hydrophobic sulfonamides ENCYSIVE PHARMACEUTICALS INC. (US) 2005-01-19 EP disclosed
EP-0946552-B1 SULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN ENCYSIVE PHARMACEUTICALS INC (US) 2004-07-07 EP disclosed