SCHEMBL8801730

SCHEMBL8801730

CSc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccc(C)cc2)nc1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 3/20 0.81
EDNRA P25101 2/20 0.73

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
SCHEMBL8657549 0.99 EDNRB (0.80) EDNRBEDNRA
SCHEMBL8801001 0.92 EDNRB (0.71) EDNRBEDNRA
SCHEMBL8802228 0.92 EDNRB (0.68) EDNRBEDNRA
SCHEMBL8660599 0.92 EDNRB (0.79) EDNRBEDNRA
SCHEMBL7481169 0.91 EDNRB (0.68) EDNRBEDNRA
SCHEMBL8662783 0.91 EDNRB (0.67) EDNRBEDNRA
SCHEMBL8658710 0.91 EDNRB (0.77) EDNRBEDNRA
SCHEMBL8660648 0.91 EDNRB (0.67) EDNRBEDNRA
SCHEMBL8802155 0.90 EDNRB (0.66) EDNRBEDNRA
SCHEMBL8659179 0.90 EDNRB (0.84) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0658548-B1 Benzenesulfonamide derivative and process for preparing thereof TANABE SEIYAKU CO (JP) 1997-11-19 EP claimed
US-5589478-A ENDOTHELIN ANTAGONISTS TANABE SEIYAKU CO., LTD. (JP) 1996-12-31 US claimed
EP-0658548-A1 Benzenesulfonamide derivative and process for preparing thereof TANABE SEIYAKU CO., LTD. (JP) 1995-06-21 EP claimed