SCHEMBL9046770

SCHEMBL9046770

Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)C)cc3)ncnc2OCCO)cc1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 5/20 0.75
EDNRB P24530 5/20 0.72

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
SCHEMBL9053186 0.96 EDNRA (0.78) EDNRAEDNRB
SCHEMBL9044009 0.93 EDNRA (0.86) EDNRAEDNRB
SCHEMBL9045370 0.92 EDNRA (0.86) EDNRAEDNRB
SCHEMBL9046501 0.91 EDNRA (0.70) EDNRAEDNRB
SCHEMBL9046504 0.90 EDNRA (0.69) EDNRAEDNRB
SCHEMBL9044945 0.90 EDNRA (0.89) EDNRAEDNRB
SCHEMBL9047331 0.89 EDNRA (0.68) EDNRAEDNRB
SCHEMBL9044364 0.89 EDNRA (0.79) EDNRAEDNRB
SCHEMBL9046028 0.88 EDNRA (0.81) EDNRAEDNRB
SCHEMBL9053381 0.88 EDNRA (0.78) 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
EP-0510526-B1 Use of sulfonamides as drug and new sulfonamides HOFFMANN LA ROCHE (CH) 1996-12-04 EP claimed