SCHEMBL6639249

SCHEMBL6639249

COc1ccc(CCC(=O)N(C)Cc2cc(-c3ncco3)ccc2-c2ccccc2S(=O)(=O)Nc2onc(C)c2C)cc1

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 19/20 0.87
EDNRA P25101 16/20 0.76

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
SCHEMBL7412005 0.93 EDNRB (0.87) EDNRBEDNRA
SCHEMBL6642249 0.93 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6638555 0.89 EDNRB (0.92) EDNRBEDNRA
SCHEMBL7403460 0.88 EDNRB (0.85) EDNRBEDNRA
SCHEMBL7406249 0.87 EDNRB (0.84) EDNRBEDNRA
SCHEMBL6637993 0.87 EDNRB (0.83) EDNRBEDNRA
SCHEMBL6640358 0.86 EDNRB (1.00) EDNRBEDNRA
SCHEMBL6641562 0.86 EDNRB (0.84) EDNRBEDNRA
SCHEMBL7399050 0.86 EDNRB (0.81) EDNRBEDNRA
SCHEMBL6641263 0.86 EDNRB (0.72) 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 1 patent. 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