SCHEMBL892538

SCHEMBL892538

Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)CO)cc3)ncnc2OCCOc2ncc(Br)cn2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 3/20 1.00
EDNRA P25101 3/20 1.00

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
SCHEMBL5032972 0.99 EDNRB (0.98) EDNRBEDNRA
SCHEMBL8804417 0.92 EDNRB (0.86) EDNRBEDNRA
SCHEMBL795650 0.91 EDNRB (1.00) EDNRBEDNRA
SCHEMBL7206507 0.89 EDNRB (0.83) EDNRBEDNRA
SCHEMBL8802029 0.89 EDNRB (0.84) EDNRBEDNRA
SCHEMBL8659586 0.89 EDNRA (0.85) EDNRBEDNRA
SCHEMBL8660578 0.87 EDNRB (0.90) EDNRBEDNRA
SCHEMBL8659093 0.85 EDNRB (0.81) EDNRBEDNRA
SCHEMBL8801607 0.84 EDNRB (0.84) EDNRBEDNRA
SCHEMBL8662305 0.84 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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6395741-B1 SENSITIVITY TO ENDOTHELIN; UROGENITAL DISORDERS TANABE SEIYAKU CO., LTD. (JP) 2002-05-28 US claimed
EP-1066831-A1 PREVENTIVES/REMEDIES FOR URINARY DISORDER TANABE SEIYAKU CO., LTD. (JP) 2001-01-10 EP claimed
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
JP-11343239-A None JP disclosed
EP-2604256-B1 Multi layer coatings HEXAL AG (DE) 2016-04-13 EP disclosed
EP-2604256-A1 Multi layer coatings Hexal AG (DE) 2013-06-19 EP disclosed
US-20120082721-A1 Enteric coating H E X A L AKTIENGESELLSCHAFT (DE) 2012-04-05 US disclosed
EP-2255794-A1 Enteric coating H e x a l Aktiengesellschaft (DE) 2010-12-01 EP disclosed
US-6610518-B2 Using Cytochrome p450 PFIZER INC. 2003-08-26 US disclosed
US-6395741-B1 SENSITIVITY TO ENDOTHELIN; UROGENITAL DISORDERS TANABE SEIYAKU CO., LTD. (JP) 2002-05-28 US disclosed
US-20020012977-A1 Enzymatic oxidations PFIZER PRODUCTS INC. 2002-01-31 US disclosed
EP-1160331-A1 Enzymatic oxidations Pfizer Limited (GB) 2001-12-05 EP disclosed
EP-1066831-A1 PREVENTIVES/REMEDIES FOR URINARY DISORDER TANABE SEIYAKU CO., LTD. (JP) 2001-01-10 EP disclosed
JP-H11343239-A PREVENTING AND THERAPEUTIC AGENT FOR DYSURIA TANABE SEIYAKU CO LTD 1999-12-14 JP disclosed