SCHEMBL8990127

SCHEMBL8990127

COC(=O)c1cc(=O)n(-c2cccc(S(=O)(=O)O)c2)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 12/20 0.54
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.42
CTSA P10619 4/20 0.41
CTSG P08311 1/20 0.38
CMA1 P23946 1/20 0.38

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
SCHEMBL8990119 0.88 ALDH1A1 (0.51) ALKBH5MEN1KMT2ACTSA
SCHEMBL8990104 0.86 ALKBH5 (0.49) ALKBH5CTSA
SCHEMBL11043787 0.85 ALKBH5 (0.49) ALKBH5MEN1KMT2ATSHR
SCHEMBL693103 0.85 ALKBH5 (0.64) ALKBH5TSHRCTSA
SCHEMBL1819463 0.81 ALKBH5 (0.61) ALKBH5MEN1KMT2ATSHRCTSA
SCHEMBL393039 0.80 ALDH1A1 (0.53) ALKBH5MEN1KMT2ATSHR
SCHEMBL10698670 0.80 ALDH1A1 (0.53) ALKBH5MEN1KMT2ATSHR
SCHEMBL10626579 0.79 ALKBH5 (0.56) ALKBH5TSHRCTSA
SCHEMBL8990134 0.79 CASP6 (0.42) ALKBH5MEN1KMT2ATSHRCTSA
SCHEMBL10400767 0.77 ALDH1A1 (0.47) ALKBH5TSHR

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