SCHEMBL8990086

SCHEMBL8990086

CCOC(=O)c1cc(=O)n(-c2cc(Cl)c(S(=O)(=O)O)cc2Cl)[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
KDM4E B2RXH2 2/20 0.58
BAZ2B Q9UIF8 1/20 0.38
BAZ2A Q9UIF9 1/20 0.38
MAPT P10636 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
POLB P06746 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALOX15 P16050 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL8990040 0.88 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTL3MBTL1MEN1
SCHEMBL11044229 0.83 ALDH1A1 (0.60) ALDH1A1KDM4EBAZ2BBAZ2AMAPT
SCHEMBL1266941 0.82 ALKBH5 (0.49) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL11042142 0.81 KDM4E (0.58) ALDH1A1KDM4EMAPTL3MBTL1POLB
SCHEMBL5159217 0.80 ALDH1A1 (0.58) ALDH1A1KDM4EMAPTL3MBTL1POLB
SCHEMBL692667 0.79 MAPT (0.52) ALDH1A1KDM4EMAPTL3MBTL1POLB
SCHEMBL11420507 0.79 ALDH1A1 (0.78) ALDH1A1KDM4EBAZ2BBAZ2AMAPT
SCHEMBL9384017 0.79 ALDH1A1 (0.82) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL9397382 0.79 ALDH1A1 (0.57) ALDH1A1KDM4EMAPTL3MBTL1POLB
SCHEMBL11420534 0.77 ALDH1A1 (0.68) ALDH1A1KDM4EBAZ2BBAZ2AMAPT

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
US-RE35359-E Amine salts of azo pigments based on pyrazolone derivatives CIBA-GEIGY CORPORATION (US) 1996-10-22 US 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