SCHEMBL14289231

SCHEMBL14289231

CCCS(=O)(=O)Nc1ncnc(OCCOc2ncc(SC)cn2)c1-c1ccc(C)cc1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 12/20 0.70
EDNRA P25101 12/20 0.70

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
SCHEMBL14289220 0.93 EDNRB (0.68) EDNRBEDNRA
SCHEMBL5501326 0.89 EDNRB (0.89) EDNRBEDNRA
SCHEMBL14289232 0.88 EDNRB (0.71) EDNRBEDNRA
SCHEMBL5494210 0.82 EDNRA (1.00) EDNRBEDNRA
SCHEMBL5497129 0.81 EDNRB (0.76) EDNRBEDNRA
SCHEMBL8801730 0.81 EDNRB (0.81) EDNRBEDNRA
SCHEMBL8657549 0.81 EDNRB (0.80) EDNRBEDNRA
SCHEMBL14289221 0.81 EDNRB (0.65) EDNRBEDNRA
SCHEMBL5497920 0.80 EDNRA (0.87) EDNRBEDNRA
SCHEMBL14380530 0.79 EDNRA (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7323465-B2 Alkansulfonamides as endothelin antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2008-01-29 US disclosed
US-7323465-B2 Alkansulfonamides as endothelin antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2008-01-29 US disclosed