SCHEMBL6639611

SCHEMBL6639611

COCCOCN(c1onc(C)c1C)S(=O)(=O)c1ccccc1-c1ccc(-c2ncco2)cc1Cn1nccn1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 19/20 0.54
EDNRA P25101 18/20 0.54

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
SCHEMBL6643190 0.93 EDNRB (0.64) EDNRBEDNRA
SCHEMBL6643297 0.93 EDNRB (0.51) EDNRBEDNRA
SCHEMBL6640325 0.91 EDNRA (0.52) EDNRBEDNRA
SCHEMBL6644386 0.91 EDNRA (0.51) EDNRBEDNRA
SCHEMBL6641004 0.91 EDNRB (0.54) EDNRBEDNRA
SCHEMBL6644096 0.91 EDNRB (0.49) EDNRBEDNRA
SCHEMBL6644002 0.90 EDNRA (0.62) EDNRBEDNRA
SCHEMBL6640029 0.90 EDNRA (0.49) EDNRBEDNRA
SCHEMBL6639674 0.90 EDNRA (0.49) EDNRBEDNRA
SCHEMBL6637163 0.90 EDNRA (0.62) 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 disclosed
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US disclosed