SCHEMBL7862213

SCHEMBL7862213

CCOC(=O)CCS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.69
LMNA P02545 2/20 0.69
ALDH1A1 P00352 8/20 0.66
GAA P10253 2/20 0.66
KDM4E B2RXH2 1/20 0.56
MAPT P10636 1/20 0.56

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
SCHEMBL7862198 0.87 LMNA (0.55) KMT2ALMNAALDH1A1GAAKDM4E
SCHEMBL7870795 0.87 ALDH1A1 (0.71) KMT2ALMNAALDH1A1GAAKDM4E
SCHEMBL7874122 0.87 KMT2A (0.58) KMT2ALMNAALDH1A1GAAKDM4E
SCHEMBL7867055 0.87 LMNA (0.55) KMT2ALMNAALDH1A1GAA
SCHEMBL28244926 0.87 LMNA (0.65) KMT2ALMNAALDH1A1GAAKDM4E
SCHEMBL7866944 0.86 LMNA (0.53) KMT2ALMNAALDH1A1GAAKDM4E
SCHEMBL7874157 0.85 KMT2A (0.71) KMT2ALMNAALDH1A1GAA
SCHEMBL27466607 0.84 LMNA (0.63) KMT2ALMNAALDH1A1GAA
SCHEMBL14578750 0.83 LMNA (0.61) KMT2ALMNAALDH1A1GAA
SCHEMBL7870173 0.83 ALDH1A1 (0.68) KMT2ALMNAALDH1A1KDM4EMAPT

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
EP-0994104-A1 ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP claimed
CN-108276313-A A method of synthesizing (S) -2- p-toluenesulfonyl ethyl propionates using micro flow field technology continuous flow 东南大学 2018-07-13 CN disclosed
CN-102786490-A Synthesis method of fenoxaprop ANHUI FENGLE AGROCHEMICAL CO 2012-11-21 CN disclosed
US-6300514-B1 INHIBITING MATRIX METALLOPROTEINASES ONO PHARMACEUTICAL CO., LTD. (JP) 2001-10-09 US disclosed
EP-0994104-A1 ARYL (SULFIDE, SULFOXIDE AND SULFONE) DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2000-04-19 EP disclosed