SCHEMBL8685133

SCHEMBL8685133

Cc1noc(NS(=O)(=O)c2cc(-c3ccccn3)ccc2-c2ccccc2)c1C

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 15/20 0.78
EDNRB P24530 10/20 0.78

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
SCHEMBL8684661 0.89 EDNRA (0.78) EDNRAEDNRB
SCHEMBL7948221 0.88 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8471717 0.85 EDNRA (0.80) EDNRAEDNRB
SCHEMBL6151288 0.81 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8347194 0.81 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8707195 0.80 EDNRA (0.82) EDNRAEDNRB
SCHEMBL7947185 0.79 EDNRA (1.00) EDNRAEDNRB
SCHEMBL9088050 0.78 EDNRA (0.77) EDNRAEDNRB
SCHEMBL8568947 0.78 EDNRA (1.00) EDNRAEDNRB
SCHEMBL8573377 0.78 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5780473-A Substituted biphenyl sulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 1998-07-14 US claimed