SCHEMBL5529070

SCHEMBL5529070

CCCCc1ccccc1-c1ccc(COS(C)(=O)=O)cc1S(=O)(=O)N(COC(C)[Si](C)(C)C)c1onc(C)c1C

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 6/20 0.34
EDNRB P24530 1/20 0.34
AGTR1 P30556 1/20 0.34

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
SCHEMBL4765080 0.94 EDNRA (0.37) EDNRAEDNRBAGTR1
SCHEMBL5531222 0.89 EDNRA (0.36) EDNRAEDNRBAGTR1
SCHEMBL4774738 0.88 EDNRA (0.36) EDNRAEDNRB
SCHEMBL5529066 0.87 EDNRA (0.35) EDNRAAGTR1
SCHEMBL5531007 0.86 EDNRA (0.41) EDNRAEDNRBAGTR1
SCHEMBL4770734 0.86 EDNRA (0.35) EDNRAEDNRB
SCHEMBL4769082 0.84 EDNRA (0.38) EDNRAAGTR1
SCHEMBL4765035 0.84 EDNRA (0.33) EDNRAEDNRB
SCHEMBL4774155 0.84 EDNRA (0.34) EDNRAEDNRB
SCHEMBL4771379 0.82 EDNRA (0.34) 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-1741713-A2 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists Bristol-Myers Squibb Company (US) 2007-01-10 EP disclosed