SCHEMBL8801832

SCHEMBL8801832

Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)ncnc2OCCOc2ccc(NC(=O)C(C)(C)C)cn2)cc1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 3/20 0.69
EDNRB P24530 3/20 0.64

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
SCHEMBL8802230 0.93 EDNRA (0.70) EDNRAEDNRB
SCHEMBL8801858 0.90 EDNRA (0.66) EDNRAEDNRB
SCHEMBL8659449 0.85 EDNRA (0.73) EDNRAEDNRB
SCHEMBL8659114 0.84 EDNRA (0.71) EDNRAEDNRB
SCHEMBL8659517 0.83 EDNRA (0.69) EDNRAEDNRB
SCHEMBL9044621 0.82 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8662305 0.80 EDNRB (0.84) EDNRAEDNRB
SCHEMBL7200249 0.80 EDNRA (0.83) EDNRAEDNRB
SCHEMBL8659501 0.79 EDNRA (0.79) EDNRAEDNRB
SCHEMBL8657467 0.79 EDNRA (0.79) 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 2 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 disclosed
US-5589478-A ENDOTHELIN ANTAGONISTS TANABE SEIYAKU CO., LTD. (JP) 1996-12-31 US disclosed