SCHEMBL8990134

SCHEMBL8990134

CC(=O)Nc1cc(=O)n(-c2cccc(S(=O)(=O)O)c2)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.42
ALKBH5 Q6P6C2 4/20 0.40
NOX4 Q9NPH5 1/20 0.39
TSHR P16473 2/20 0.36
CTSA P10619 1/20 0.36
GAA P10253 1/20 0.36
HTR6 P50406 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
KDM4E B2RXH2 2/20 0.35
ALOX15 P16050 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PKM P14618 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAOA P21397 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
SCHEMBL11653654 0.87 CASP6 (0.35) CASP6ALKBH5NOX4TSHRGAA
SCHEMBL11496671 0.86 ALKBH5 (0.40) CASP6ALKBH5TSHRGAAHTR6
SCHEMBL10915383 0.81 TSHR (0.52) ALKBH5TSHRCTSAALDH1A1HSD17B10
SCHEMBL10698670 0.79 ALDH1A1 (0.53) ALKBH5NOX4TSHRGAAALDH1A1
SCHEMBL393039 0.79 ALDH1A1 (0.53) ALKBH5NOX4TSHRGAAALDH1A1
SCHEMBL8990127 0.79 ALKBH5 (0.54) ALKBH5TSHRCTSAMEN1KMT2A
SCHEMBL8990104 0.78 ALKBH5 (0.49) ALKBH5CTSA
SCHEMBL693103 0.76 ALKBH5 (0.64) ALKBH5TSHRCTSAALDH1A1HSD17B10
SCHEMBL10400767 0.76 ALDH1A1 (0.47) ALKBH5TSHRHTR6ALDH1A1HSD17B10
SCHEMBL11530596 0.75 TSHR (0.43) ALKBH5TSHRCTSAHTR6ALDH1A1

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 6 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-0241413-A2 Amine salts of azo compounds CIBA-GEIGY AG (CH) 1987-10-14 EP disclosed