SCHEMBL9044409

SCHEMBL9044409

Cc1nc(Cl)c(-c2ccc(Cl)cc2)c(NS(=O)(=O)c2ccc(Cl)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
POLB P06746 1/20 0.55
HSD11B1 P28845 1/20 0.51
KDM1A O60341 5/20 0.50
MAOA P21397 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.48
EDNRB P24530 1/20 0.47
EDNRA P25101 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
CES1 P23141 1/20 0.45
MAPT P10636 2/20 0.44
CCR4 P51679 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL9046119 0.87 FFAR4 (0.53) ALDH1A1POLBKDM1AMAOAMEN1
SCHEMBL9047044 0.80 EDNRA (0.71) ALDH1A1HSD11B1KDM1AMAOAEDNRB
SCHEMBL9046709 0.77 ALDH1A1 (0.60) ALDH1A1POLBHSD11B1KDM1AMAOA
SCHEMBL9047067 0.75 EDNRB (0.59) ALDH1A1POLBHSD11B1KDM1AMAOA
SCHEMBL9044830 0.75 MAPT (0.53) ALDH1A1L3MBTL1MEN1KMT2AMAPT
SCHEMBL9046378 0.73 EDNRA (0.57) ALDH1A1POLBHSD11B1KDM1AEDNRB
SCHEMBL9045052 0.72 MEN1 (0.55) ALDH1A1KDM1AMAOAEDNRBEDNRA
SCHEMBL8659102 0.72 EDNRA (0.49) ALDH1A1EDNRBEDNRAMEN1KMT2A
SCHEMBL9045764 0.72 EDNRB (0.59) ALDH1A1POLBEDNRBEDNRAMEN1
SCHEMBL9495682 0.72 EDNRB (0.59) ALDH1A1POLBEDNRBEDNRAMEN1

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