SCHEMBL8568947

SCHEMBL8568947

Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3cnccn3)cc2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 18/20 1.00
EDNRB P24530 11/20 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
SCHEMBL7948221 0.89 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8573377 0.85 EDNRA (1.00) EDNRAEDNRB
SCHEMBL7951160 0.85 EDNRA (1.00) EDNRAEDNRB
SCHEMBL7947185 0.85 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8350252 0.84 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6777867 0.83 EDNRA (0.86) EDNRAEDNRB
SCHEMBL6151288 0.83 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8566691 0.83 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8347194 0.82 EDNRA (1.00) EDNRAEDNRB
SCHEMBL6641232 0.82 EDNRA (1.00) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0725067-A1 Substituted biphenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 1996-08-07 EP claimed
US-5780473-A Substituted biphenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 1998-07-14 US disclosed
US-5760038-A Substituted biphenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 1998-06-02 US disclosed
EP-0725067-A1 Substituted biphenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 1996-08-07 EP disclosed