SCHEMBL4417172

SCHEMBL4417172

[O]c1ccccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
KEAP1 Q14145 2/20 0.63
IL1RN P18510 1/20 0.63
ERAP1 Q9NZ08 1/20 0.63
RECQL P46063 2/20 0.59
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
PKM P14618 3/20 0.59
MAPT P10636 4/20 0.56
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
G6PD P11413 1/20 0.51
NFKBIA P25963 1/20 0.51
AGTR1 P30556 1/20 0.51

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
SCHEMBL2067538 0.87 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2KEAP1IL1RNERAP1
SCHEMBL522424 0.85 LMNA (0.72) ALDH1A1SMN1; SMN2KEAP1MEN1KMT2A
SCHEMBL13212307 0.80 ALDH1A1 (0.77) ALDH1A1SMN1; SMN2KEAP1IL1RNERAP1
SCHEMBL9345893 0.80 GAA (0.69) ALDH1A1SMN1; SMN2KEAP1IL1RNERAP1
SCHEMBL25031372 0.78 KEAP1 (1.00) ALDH1A1KEAP1IL1RNERAP1MEN1
Phenyl(Phenylsulfonyl)Amine SCHEMBL114765 0.78 KEAP1 (1.00) ALDH1A1KEAP1IL1RNERAP1MEN1
SCHEMBL810795 0.78 KMT2A (0.91) ALDH1A1SMN1; SMN2KEAP1IL1RNERAP1
SCHEMBL13146416 0.78 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2KEAP1IL1RNERAP1
SCHEMBL6801689 0.78 RECQL (0.62) ALDH1A1SMN1; SMN2KEAP1IL1RNERAP1
SCHEMBL3791578 0.78 TSHR (0.74) ALDH1A1SMN1; SMN2KEAP1IL1RNERAP1

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
WO-2008040002-A9 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR HIF MODULATING COMPOUNDS HUTCHINSON FRED CANCER RES (US) 2009-04-16 WO disclosed
WO-2008040002-A2 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR HIF MODULATING COMPOUNDS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2008-04-03 WO disclosed
EP-1893186-A2 IMPROVED TREATMENT FOR ANEMIA USING A HIF-ALPHA STABILISING AGENT FIBROGEN, INC. (US) 2008-03-05 EP disclosed
WO-2006133391-A2 IMPROVED TREATMENT FOR ANEMIA USING A HIF-ALPHA STABILISING AGENT FIBROGEN, INC. (US) 2006-12-14 WO disclosed
US-5155015-A Containing dye which is easily decolorized or eluted during processing FUJI PHOTO FILM CO., LTD. (JP) 1992-10-13 US disclosed