SCHEMBL6642841

SCHEMBL6642841

Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2C(O)c2ncc(-c3ccccc3)o2)c1C

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 20/20 0.63
EDNRB P24530 19/20 0.63

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
SCHEMBL6639475 0.85 EDNRA (0.67) EDNRAEDNRB
SCHEMBL6639806 0.84 EDNRA (0.82) EDNRAEDNRB
SCHEMBL6640375 0.82 EDNRA (0.80) EDNRAEDNRB
SCHEMBL7398413 0.81 EDNRA (0.72) EDNRAEDNRB
SCHEMBL6641034 0.81 EDNRA (0.79) EDNRAEDNRB
SCHEMBL6641421 0.80 EDNRA (0.75) EDNRAEDNRB
SCHEMBL6639687 0.80 EDNRA (0.80) EDNRAEDNRB
SCHEMBL6640568 0.79 EDNRA (0.41) EDNRAEDNRB
SCHEMBL8471717 0.78 EDNRA (0.80) EDNRAEDNRB
SCHEMBL6639757 0.78 EDNRA (0.74) 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-0921800-B1 SUBSTITUTED BIPHENYL ISOXAZOLE SULFONAMIDES BRISTOL MYERS SQUIBB CO (US) 2004-04-14 EP claimed
EP-0921800-B1 SUBSTITUTED BIPHENYL ISOXAZOLE SULFONAMIDES BRISTOL MYERS SQUIBB CO (US) 2004-04-14 EP disclosed