SCHEMBL4287019

SCHEMBL4287019

Cc1cc(OCc2ccc(-c3ccccc3S(=O)(=O)Nc3noc(C)c3C)cc2)nc(C)n1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 10/20 0.44
EDNRB P24530 8/20 0.44

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
SCHEMBL4773314 0.83 EDNRA (0.42) EDNRAEDNRB
SCHEMBL4773257 0.83 AGTR1 (0.51) EDNRAEDNRB
SCHEMBL13574889 0.81 EDNRA (0.44) EDNRAEDNRB
SCHEMBL4771492 0.78 AGTR1 (0.51) EDNRAEDNRB
SCHEMBL13574892 0.77 EDNRA (0.54) EDNRAEDNRB
SCHEMBL7557151 0.77 EDNRA (0.64) EDNRAEDNRB
SCHEMBL6767700 0.77 EDNRA (0.70) EDNRAEDNRB
SCHEMBL4793147 0.77 EDNRA (0.44) EDNRAEDNRB
SCHEMBL4774477 0.76 AGTR1 (0.53) EDNRA
SCHEMBL27541757 0.76 ADAM17 (0.40) 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
WO-2009155448-A1 BIPHENYL SULFONAMIDES AS DUAL ANGIOTENSIN ENDOTHELIN RECEPTOR ANTAGONISTS LIGAND PHARMACEUTICALS INC. (US) 2009-12-23 WO claimed