SCHEMBL4774085

SCHEMBL4774085

Cc1noc(N(COCC[Si](C)(C)C)S(=O)(=O)c2ccccc2-c2ccc(COS(C)(=O)=O)cc2Cl)c1C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 3/20 0.36

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
SCHEMBL5531220 0.91 EDNRA (0.37) EDNRA
SCHEMBL5787828 0.90 EDNRA (0.37) EDNRA
SCHEMBL4772907 0.89 EDNRA (0.35) EDNRA
SCHEMBL4771374 0.88 EDNRA (0.32) EDNRA
SCHEMBL5531005 0.88 EDNRA (0.41) EDNRA
SCHEMBL4770730 0.88 EDNRA (0.38) EDNRA
SCHEMBL4767237 0.88 EDNRB (0.39) EDNRA
SCHEMBL4774149 0.87 EDNRA (0.34) EDNRA
SCHEMBL4765078 0.87 EDNRA (0.38) EDNRA
SCHEMBL4770728 0.86 EDNRA (0.38) EDNRA

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-2002837-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-17 EP disclosed