SCHEMBL6642249

SCHEMBL6642249

Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2CN(C)C(=O)CCc2ccccc2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 19/20 1.00
EDNRA P25101 16/20 0.86

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
SCHEMBL6638555 0.96 EDNRB (0.92) EDNRBEDNRA
SCHEMBL6639249 0.93 EDNRB (0.87) EDNRBEDNRA
SCHEMBL6640358 0.93 EDNRB (1.00) EDNRBEDNRA
SCHEMBL9038733 0.90 EDNRB (0.82) EDNRBEDNRA
SCHEMBL6645243 0.90 EDNRB (0.88) EDNRBEDNRA
SCHEMBL6637993 0.89 EDNRB (0.83) EDNRBEDNRA
SCHEMBL6641311 0.89 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6639342 0.89 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6644468 0.89 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6644310 0.89 EDNRB (0.92) 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 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