SCHEMBL7589605

SCHEMBL7589605

Cc1ccc(NC(=O)c2sccc2S(=O)(=O)Nc2onc(C)c2Cl)c(C)c1S(C)(=O)=O

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 20/20 0.70
EDNRB P24530 9/20 0.70

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
SCHEMBL4632411 0.87 EDNRA (0.81) EDNRAEDNRB
SCHEMBL4630657 0.86 EDNRA (0.73) EDNRAEDNRB
SCHEMBL27491258 0.85 EDNRA (0.75) EDNRAEDNRB
SCHEMBL4632363 0.85 EDNRA (0.82) EDNRAEDNRB
SCHEMBL4631353 0.84 EDNRA (0.81) EDNRAEDNRB
SCHEMBL4631405 0.84 EDNRA (0.84) EDNRAEDNRB
SCHEMBL6588138 0.83 EDNRA (0.80) EDNRAEDNRB
SCHEMBL27508438 0.83 EDNRA (0.76) EDNRAEDNRB
SCHEMBL4630639 0.82 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6150988 0.82 EDNRA (0.84) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980369-A1 SULFONAMIDES FOR TREATMENT OF ENDOTHELIN-MEDIATED DISORDERS TEXAS BIOTECHNOLOGY CORPORATION (US) 2000-02-23 EP disclosed
WO-1998049162-A1 SULFONAMIDES FOR TREATMENT OF ENDOTHELIN-MEDIATED DISORDERS TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-11-05 WO disclosed