SCHEMBL9052960

SCHEMBL9052960

O=S(=O)(Nc1ncnc(OCCO)c1Cc1ccc2ccccc2c1)c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 8/20 0.60
EDNRB P24530 5/20 0.60
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CCR4 P51679 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.38
PIK3CG P48736 1/20 0.38

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
SCHEMBL9045980 0.84 MEN1 (0.47) EDNRAEDNRBMEN1KMT2AALDH1A1
SCHEMBL9045435 0.83 EDNRA (0.60) EDNRAEDNRBMEN1KMT2AALDH1A1
SCHEMBL9045266 0.82 EDNRA (0.79) EDNRAEDNRBMEN1KMT2AALDH1A1
SCHEMBL9045035 0.79 EDNRA (0.61) EDNRAEDNRBMEN1KMT2AALDH1A1
SCHEMBL9045073 0.76 EDNRA (0.62) EDNRAEDNRB
SCHEMBL9046616 0.76 EDNRA (0.59) EDNRAEDNRBSMN1; SMN2POLB
SCHEMBL9045531 0.76 EDNRA (0.64) EDNRAEDNRBMEN1KMT2AALDH1A1
SCHEMBL9044052 0.75 EDNRA (0.89) EDNRAEDNRB
SCHEMBL9044159 0.75 EDNRA (0.58) EDNRAEDNRBPIK3CG
SCHEMBL9043320 0.75 EDNRA (0.80) 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 3 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 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