SCHEMBL4632091

SCHEMBL4632091

Cc1noc(NS(=O)(=O)c2sccc2CCC(C)C)c1Br

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 20/20 0.73
EDNRB P24530 19/20 0.73

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
SCHEMBL6150690 0.85 EDNRA (1.00) EDNRAEDNRB
SCHEMBL4631830 0.83 EDNRA (0.77) EDNRAEDNRB
SCHEMBL4631475 0.83 EDNRB (1.00) EDNRAEDNRB
SCHEMBL6151709 0.83 EDNRA (0.84) EDNRAEDNRB
SCHEMBL4631361 0.82 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6151279 0.82 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6151304 0.82 EDNRA (1.00) EDNRAEDNRB
SCHEMBL27468571 0.81 EDNRA (0.81) EDNRAEDNRB
SCHEMBL6150936 0.81 EDNRA (1.00) EDNRAEDNRB
Toluene SCHEMBL27455218 0.81 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-1498418-B1 Sulfonamides for treatment of endothelin-mediated disorders ENCYSIVE PHARMACEUTICALS INC (US) 2008-05-21 EP disclosed