SCHEMBL11043787

SCHEMBL11043787

COC(=O)c1cc(=O)n(-c2ccc(S(=O)(=O)O)cc2)[nH]1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 13/20 0.49
TSHR P16473 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
GAA P10253 2/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 2/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL9324636 0.87 ALDH1A1 (0.54) ALKBH5ALDH1A1MAPTGAAHTT
SCHEMBL10405696 0.87 ALDH1A1 (0.54) ALKBH5ALDH1A1MAPTGAAHTT
SCHEMBL8990127 0.85 ALKBH5 (0.54) ALKBH5TSHRKMT2AMEN1
SCHEMBL11807463 0.85 ALKBH5 (0.51) ALKBH5ALDH1A1MAPTGAAHTT
SCHEMBL67421 0.84 ALKBH5 (0.66) ALKBH5ALDH1A1MAPTKMT2AKDM4E
SCHEMBL11437033 0.83 ALKBH5 (0.49) ALKBH5ALDH1A1MAPTGAAHTT
SCHEMBL11647578 0.82 ALKBH5 (0.52) ALKBH5TSHRALDH1A1MAPTGAA
SCHEMBL1819463 0.81 ALKBH5 (0.61) ALKBH5TSHRALDH1A1MAPTGAA
SCHEMBL10654204 0.80 ALDH1A1 (0.60) ALKBH5ALDH1A1MAPTGAAHTT
SCHEMBL10873349 0.78 ALKBH5 (0.42) ALKBH5TSHRALDH1A1MAPTGAA

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-4490151-A Disazo sulfophenylpyrazolonestilbene dyes and direct dyes to color cellulose black CROMPTON AND KNOWLES CORPORATION (US) 1984-12-25 US disclosed
US-4455258-A Disazo sulfophenylpyrazolone-sulfostilbene dyes CROMPTON AND KNOWLES CORPORATION (US) 1984-06-19 US disclosed
US-4218432-A Coloring agent and a composition including the same for coloring toilet bowl flushing water YAMAMOTO KAGAKU GOSEI CO., LTD. (JP) 1980-08-19 US disclosed
US-4144231-A Soluble trisazo dyestuffs containing a 2-phenyl-benzimidazolyl, -benzoxazolyl or -benzthiazolyl middle component CASSELLA AKTIENGESELLSCHAFT (DE) 1979-03-13 US disclosed
US-4143033-A WATER-SOLUBLE DISAZO DYESTUFFS CONTAINING A 2-PHENYL-BENZIMIDAZOLYL,-BENZOXAZOLYL OR-BENZTHIAZOLYL MIDDLE COMPONENT CASSELLA AKTIENGESELLSCHAFT (DE) 1979-03-06 US disclosed