SCHEMBL522695

SCHEMBL522695

COC(=O)c1cc(F)c(C(=O)OC)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.57
POLB P06746 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
XDH P47989 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
LMNA P02545 2/20 0.57
GAA P10253 1/20 0.57
NFKB1 P19838 1/20 0.57
GFER P55789 1/20 0.57
NFKB2 Q00653 1/20 0.57
RELA Q04206 1/20 0.57
FUT7 Q11130 1/20 0.57
CA1 P00915 5/20 0.54
CA2 P00918 5/20 0.54
CA12 O43570 4/20 0.54
CA7 P43166 4/20 0.54
CA9 Q16790 4/20 0.54
CA14 Q9ULX7 4/20 0.54
MAPT P10636 2/20 0.51
ALDH1A1 P00352 2/20 0.48

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
SCHEMBL14060389 0.88 KDM4E (0.53) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL12426969 0.88 LMNA (0.50) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL793325 0.87 KDM4E (0.48) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL14059723 0.86 KDM4E (0.52) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL31455774 0.85 KDM4E (0.43) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL1096952 0.84 KDM4E (0.59) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL1110779 0.84 KMT2A (0.49) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL27438708 0.83 F10 (0.41) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL197844 0.83 CYP3A4 (0.55) KDM4EPOLBL3MBTL1XDHTDP1
SCHEMBL12121020 0.83 CYP3A4 (0.46) KDM4EPOLBL3MBTL1XDHTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102365255-B Method for producing alcohol compound and catalyst therefor SUMITOMO CHEMICAL CO 2015-01-07 CN disclosed
CN-102365254-B Method for producing alcohol compound SUMITOMO CHEMICAL CO 2014-08-27 CN disclosed
CN-101479221-B Method for production of halogen-substituted benzenedimethanol SUMITOMO CO LTD 2013-01-16 CN disclosed
CN-101356146-B Process for preparing halogen substituted benzenedimethanol SUMITOMO CO LTD 2013-01-02 CN disclosed
EP-2415741-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND Sumitomo Chemical Company, Limited (JP) 2012-02-08 EP disclosed
US-20120029195-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND AND CATALYST THEREFOR SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-02 US disclosed
US-20120010417-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-12 US disclosed
US-7973201-B2 Process for production of halogen-substituted benzenedimethanol SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-05 US disclosed
EP-1783108-B1 METHOD FOR PRODUCING HALOGEN-SUBSTITUTED BENZENEDIMETHANOL SUMITOMO CHEMICAL CO (JP) 2010-12-22 EP disclosed
US-20100174122-A1 PROCESS FOR PRODUCTION OF HALOGEN-SUBSTITUTED BENZENEDIMETHANOL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-08 US disclosed
US-7678947-B2 reacting a halogen-substituted terephthalic acid diester with a borohydride compound in the presence of an alcohol and a solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-16 US disclosed
CN-101479221-A Method for production of halogen-substituted benzenedimethanol SUMITOMO CHEMICAL CO (JP) 2009-07-08 CN disclosed
EP-2033944-A1 PROCESS FOR PRODUCTION OF HALOGEN-SUBSTITUTED BENZENEDIMETHANOL Sumitomo Chemical Company, Limited (JP) 2009-03-11 EP disclosed
CN-101356146-A Process for preparing halogen substituted benzenedimethanol SUMITOMO CHEMICAL CO (JP) 2009-01-28 CN disclosed
US-20070213570-A1 reacting a halogen-substituted terephthalic acid diester with a borohydride compound in the presence of an alcohol and a solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-13 US disclosed
CN-101001823-A Process for making halogen substituted benzenedimethanol SUMITOMO CHEMICAL CO (JP) 2007-07-18 CN disclosed
EP-1783108-A1 METHOD FOR PRODUCING HALOGEN-SUBSTITUTED BENZENEDIMETHANOL Sumitomo Chemical Company, Limited (JP) 2007-05-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120010417-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND ADH1A, ADH1C, ADH5 KDM4E 2660/4885POLB 589/4885L3MBTL1 4455/4885
US-20070213570-A1 reacting a halogen-substituted terephthalic acid diester with a borohydride compound in the presence of an alcohol and a solvent ADH1A, ADH1C, CYP4A11 KDM4E 3330/4885POLB 2038/4885L3MBTL1 1299/4885
US-20100174122-A1 PROCESS FOR PRODUCTION OF HALOGEN-SUBSTITUTED BENZENEDIMETHANOL HRH4, HAX1, XDH KDM4E 2715/4885POLB 2395/4885L3MBTL1 2384/4885
US-20120029195-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND AND CATALYST THEREFOR ADH1A, ADH1C, ADH5 KDM4E 1708/4885POLB 1648/4885L3MBTL1 3300/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.