SCHEMBL6771345

SCHEMBL6771345

COCCOCN(c1onc(C)c1C)S(=O)(=O)c1cc(OC)ccc1-c1ccc(CC(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.43
EDNRA P25101 1/20 0.43

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
SCHEMBL6767029 0.90 EDNRB (0.42) EDNRBEDNRA
SCHEMBL6771441 0.89 EDNRB (0.42) EDNRBEDNRA
SCHEMBL6771197 0.88 EDNRB (0.54) EDNRBEDNRA
SCHEMBL6771346 0.88 EDNRB (0.43) EDNRBEDNRA
SCHEMBL6767826 0.86 EDNRB (0.41) EDNRBEDNRA
SCHEMBL6778008 0.83 EDNRB (0.40) EDNRBEDNRA
SCHEMBL6771633 0.82 EDNRA (0.44) EDNRBEDNRA
SCHEMBL6777056 0.81 EDNRA (0.45) EDNRA
SCHEMBL8044523 0.81 EDNRB (0.45) EDNRBEDNRA
SCHEMBL9089380 0.81 EDNRB (0.45) EDNRBEDNRA

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-6673824-B1 HYPOTENSIVE AGENTS BRISTOL-MYERS SQUIBB CO. 2004-01-06 US disclosed
US-6107320-A Phenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB CO. (US) 2000-08-22 US disclosed
EP-0569193-B1 N-isoxazole-phenylsulfonamide derivatives and their use as endothelin antagonists SQUIBB & SONS INC (US) 1997-02-26 EP disclosed
US-5514696-A Phenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB CO. (US) 1996-05-07 US disclosed