SCHEMBL6772980

SCHEMBL6772980

CCOC(OC)N(c1onc(C)c1C)S(=O)(=O)c1ccccc1-c1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 4/20 0.41
EDNRA P25101 4/20 0.41

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
SCHEMBL6777477 0.91 EDNRA (0.42) EDNRBEDNRA
SCHEMBL8056643 0.85 EDNRA (0.43) EDNRBEDNRA
SCHEMBL6772649 0.83 TDP1 (0.34)
SCHEMBL4632109 0.80 EDNRB (0.43) EDNRBEDNRA
SCHEMBL6772985 0.80 EDNRA (0.42) EDNRBEDNRA
SCHEMBL6777054 0.79 EDNRA (0.46) EDNRA
SCHEMBL6776263 0.79 EDNRA (0.46) EDNRA
SCHEMBL6771344 0.78 EDNRB (0.43) EDNRBEDNRA
SCHEMBL7086343 0.78 EDNRA (0.38) EDNRA
SCHEMBL4632432 0.77 MAPT (0.36)

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 3 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