SCHEMBL8990138

SCHEMBL8990138

CC(=O)Nc1cc(=O)n(-c2cc(Cl)c(S(=O)(=O)O)cc2Cl)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.36
CECR2 Q9BXF3 1/20 0.36
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
ENPP2 Q13822 1/20 0.32
ROCK2 O75116 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
HSP90AA1 P07900 3/20 0.31
HSP90AB1 P08238 3/20 0.31

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
SCHEMBL692667 0.80 MAPT (0.52) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL8990040 0.80 ALDH1A1 (0.43) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL1266941 0.78 ALKBH5 (0.49) KDM4EALDH1A1MEN1KMT2A
SCHEMBL10400766 0.78 KDM4E (0.33) KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL10995515 0.76 ALDH1A1 (0.41) ATAD2CECR2KDM4EALDH1A1MAPT
SCHEMBL6053229 0.75 KDM4E (0.30) KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL8990086 0.74 ALDH1A1 (0.58) KDM4EALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL11653654 0.74 CASP6 (0.35) ATAD2CECR2KDM4EALDH1A1MAPT
SCHEMBL11496671 0.73 ALKBH5 (0.40) ATAD2CECR2KDM4EALDH1A1MAPT
SCHEMBL9786518 0.72 NOX4 (0.44) KDM4EALDH1A1MAPTSMN1; SMN2MEN1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35359-E Amine salts of azo pigments based on pyrazolone derivatives CIBA-GEIGY CORPORATION (US) 1996-10-22 US disclosed
EP-0241413-B1 AMINE SALTS OF AZO COMPOUNDS CIBA-GEIGY AG (CH) 1993-03-03 EP disclosed
US-5151505-A Monoazo dyes containing hydroxypyrazole groups CIBA-GEIGY CORPORATION (US) 1992-09-29 US disclosed
US-4992495-A Yellow pigment CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
US-4980458-A Mixed sodium, ammonium and/or calcium salt crystals of laked monoazo disulfonated pyrazolone pigments CIBA-GEIGY CORPORATION (US) 1990-12-25 US disclosed
EP-0263074-A2 Mixed crystals of laked azo dyes CIBA-GEIGY AG (CH) 1988-04-06 EP disclosed
EP-0241413-A2 Amine salts of azo compounds CIBA-GEIGY AG (CH) 1987-10-14 EP disclosed