SCHEMBL11226077

SCHEMBL11226077

Cc1ccc(S(=O)(=O)O)c(CCI)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
HSD17B10 Q99714 2/20 0.37
MPL P40238 1/20 0.36
AMY1A P0DUB6 1/20 0.36
ALDH1A1 P00352 3/20 0.35
POLB P06746 2/20 0.35
RECQL P46063 2/20 0.35
MEP1B Q16820 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
CASP6 P55212 1/20 0.35
ELAVL1 Q15717 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
MYC P01106 1/20 0.34
RAPGEF4 Q8WZA2 1/20 0.34
HIF1A Q16665 2/20 0.33

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
SCHEMBL30823619 0.89 GAA (0.41) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL1180196 0.89 GAA (0.41) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL1805307 0.88 GAA (0.38) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL29975298 0.86 GAA (0.39) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL30723203 0.86 GAA (0.39) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL816601 0.86 GAA (0.39) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL5718625 0.86 GAA (0.39) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL30716894 0.85 AMY1A (0.44) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL14991279 0.85 AMY1A (0.44) GAAHSD17B10MPLAMY1AALDH1A1
SCHEMBL3339137 0.84 HSD17B10 (0.39) GAAHSD17B10MPLAMY1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4149873-A Composition for the regulation of plant metabolism CIBA-GEIGY CORPORATION (US) 1979-04-17 US claimed
US-4357159-A Haloethylthienylsulphonates for the regulation of plant metabolism CIBA-GEIGY CORPORATION (US) 1982-11-02 US disclosed
US-4149873-A Composition for the regulation of plant metabolism CIBA-GEIGY CORPORATION (US) 1979-04-17 US disclosed