SCHEMBL8677236

SCHEMBL8677236

CCOc1ccc(-c2ccsc2S(=O)(=O)Nc2onc(C)c2Br)cc1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 20/20 0.80
EDNRB P24530 19/20 0.80

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
SCHEMBL8679159 0.89 EDNRA (0.81) EDNRAEDNRB
SCHEMBL4632115 0.85 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6151496 0.84 EDNRA (1.00) EDNRAEDNRB
SCHEMBL4631500 0.79 EDNRA (1.00) EDNRAEDNRB
SCHEMBL4664077 0.79 EDNRA (0.88) EDNRAEDNRB
SCHEMBL4631412 0.77 EDNRA (0.71) EDNRAEDNRB
SCHEMBL27457244 0.77 EDNRA (0.70) EDNRAEDNRB
SCHEMBL4662705 0.75 EDNRA (1.00) EDNRAEDNRB
SCHEMBL4631408 0.74 EDNRA (1.00) EDNRAEDNRB
SCHEMBL7791379 0.73 EDNRA (0.77) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0699191-B1 SULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORP (US) 1998-12-16 EP claimed