SCHEMBL5471045

SCHEMBL5471045

CC[C@H](O)COS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 2/20 0.43
▸ ALDH1A1 P00352 6/20 0.41
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA4 P22748 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ DHODH Q02127 1/20 0.40
▸ GAA P10253 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ MMP8 P22894 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
SCHEMBL5471050 1.00 STAT3 (0.43) STAT3ALDH1A1CA1CA2CA4
SCHEMBL115398 1.00 STAT3 (0.43) STAT3ALDH1A1CA1CA2CA4
SCHEMBL140992 0.91 STAT3 (0.46) STAT3ALDH1A1CA1CA2CA4
SCHEMBL17457059 0.89 ALDH1A1 (0.60) ALDH1A1CA1CA2CA9GAA
SCHEMBL8355316 0.89 STAT3 (0.42) STAT3ALDH1A1CA1CA2CA4
SCHEMBL1498865 0.89 STAT3 (0.42) STAT3ALDH1A1CA1CA2CA4
SCHEMBL8355550 0.89 STAT3 (0.42) STAT3ALDH1A1CA1CA2CA4
SCHEMBL2548351 0.87 STAT3 (0.43) STAT3ALDH1A1CA1CA2CA4
SCHEMBL2548348 0.87 STAT3 (0.43) STAT3ALDH1A1CA1CA2CA4
SCHEMBL4621606 0.87 STAT3 (0.43) STAT3ALDH1A1CA1CA2CA4

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-20070026508-A1 Enzymatic method of making 1,2-diol derivatives and their esters ENZYTECH, LTD. (KR) 2007-02-01 — — US disclosed
US-20060234362-A1 Enzymatic method of making 1,2-diol derivatives and their esters with succine anhydride ENZYTECH, LTD. (KR) 2006-10-19 — — US disclosed
WO-2004106534-A1 THE ENZYMATIC METHOD OF MAKING 1,2-DIOL DERIVATIVES AND THEIR ESTERS WITH SUCCINE ANHYDRIDE ENZYTECH, LTD. (KR) 2004-12-09 — — WO disclosed
WO-2004097026-A1 THE ENZYMATIC METHOD OF MAKING 1,2-DIOL DERIVATIVES AND THEIR ESTERS ENZYTECH, LTD. (KR) 2004-11-11 — — WO disclosed
EP-0490407-A2 Process for the enzymatic separation of the optical isomers of tosyloxy-alkanols MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1992-06-17 — — EP disclosed
EP-0197484-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE GLYCOL DERIVATIVES KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-02-05 — — EP disclosed
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