SCHEMBL9045267

SCHEMBL9045267

COc1ccc(S(=O)(=O)Nc2ncnc(OCCO)c2-c2ccc(Cl)cc2)cc1OC

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 10/20 0.77
EDNRB P24530 6/20 0.77
ALDH1A1 P00352 2/20 0.48
TP53 P04637 1/20 0.48
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL9044617 0.94 EDNRA (0.77) EDNRAEDNRBTP53
SCHEMBL9043994 0.88 EDNRA (0.80) EDNRAEDNRB
SCHEMBL9044669 0.86 EDNRA (0.84) EDNRAEDNRB
SCHEMBL9044945 0.85 EDNRA (0.89) EDNRAEDNRBALDH1A1
SCHEMBL9494264 0.85 ALDH1A1 (0.55) EDNRAEDNRBALDH1A1TP53LMNA
SCHEMBL9046379 0.84 EDNRA (0.91) EDNRAEDNRB
SCHEMBL9045266 0.83 EDNRA (0.79) EDNRAEDNRBALDH1A1
SCHEMBL9045370 0.83 EDNRA (0.86) EDNRAEDNRB
SCHEMBL9044786 0.83 EDNRA (0.89) EDNRAEDNRB
SCHEMBL9043529 0.83 EDNRA (0.89) 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 5 patents. 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
EP-0510526-A1 Use of sulfonamides as drug and new sulfonamides F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) 1992-10-28 EP claimed
EP-0510526-B1 Use of sulfonamides as drug and new sulfonamides HOFFMANN LA ROCHE (CH) 1996-12-04 EP disclosed
US-5270313-A Treatment of circulatory disorders HOFFMANN-LA ROCHE INC. (US) 1993-12-14 US disclosed
EP-0510526-A1 Use of sulfonamides as drug and new sulfonamides F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) 1992-10-28 EP disclosed