SCHEMBL4575734

SCHEMBL4575734

O=S(=O)(Nc1ccccc1)ONc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 3/20 0.50
CA2 P00918 3/20 0.50
CA1 P00915 2/20 0.50
IL1RN P18510 1/20 0.48
ERAP1 Q9NZ08 1/20 0.48
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
PKM P14618 2/20 0.45
ALDH1A1 P00352 1/20 0.45
CA12 O43570 4/20 0.41
CA9 Q16790 4/20 0.41
PGR P06401 3/20 0.40
POLB P06746 1/20 0.38
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL2016598 0.79 KEAP1 (0.56) KEAP1CA2CA1IL1RNERAP1
SCHEMBL9543035 0.79 CA2 (0.44) KEAP1CA2CA1IL1RNERAP1
SCHEMBL3226500 0.77 CA2 (0.43) KEAP1CA2CA1IL1RNERAP1
SCHEMBL10579140 0.76 CA2 (0.41) KEAP1CA2CA1IL1RNERAP1
SCHEMBL9492832 0.76 KEAP1 (0.52) KEAP1CA2CA1IL1RNERAP1
SCHEMBL9009533 0.76 ACP1 (0.44) KEAP1CA2CA1IL1RNERAP1
SCHEMBL27848346 0.76 CA1 (0.52) KEAP1CA2CA1IL1RNERAP1
SCHEMBL11779981 0.76 KEAP1 (0.52) KEAP1CA2CA1IL1RNERAP1
SCHEMBL675949 0.76 KEAP1 (0.58) KEAP1CA2CA1IL1RNERAP1
SCHEMBL1729178 0.74 KMT2A (0.53) KEAP1CA2CA1IL1RNERAP1

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
CN-115232458-A Flame-retardant antibacterial transparent PC resin composition and preparation method thereof 上海金山锦湖日丽塑料有限公司 2022-10-25 CN disclosed
US-8426102-B2 Lithographic printing plate precursor and plate making method FUJIFILM CORPORATION (JP) 2013-04-23 US disclosed
US-8309294-B2 2012-11-13 US disclosed
US-20080318155-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PLATE MAKING METHOD FUJIFILM CORPORATION (JP) 2008-12-25 US disclosed
EP-2006091-A2 Lithographic printing plate precursor and plate making method FUJIFILM Corporation (JP) 2008-12-24 EP disclosed