SCHEMBL7758087

SCHEMBL7758087

O=C(OCl)C(=O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.46
TDP1 Q9NUW8 2/20 0.45
ATM Q13315 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALOX15 P16050 2/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 4/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 1/20 0.41
HSP90AA1 P07900 1/20 0.41
GAA P10253 1/20 0.41
NSD2 O96028 1/20 0.41
CYP19A1 P11511 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
Diphenyl Ethanedioat SCHEMBL43364 0.88 TDP1 (0.54) ELANETDP1ATML3MBTL1ALOX15
Diphenyl Ethanedioat SCHEMBL27942895 0.86 ELANE (0.53) ELANETDP1ATML3MBTL1ALOX15
Diphenyl Ethanedioat SCHEMBL27328178 0.85 TDP1 (0.52) ELANETDP1ATML3MBTL1ALOX15
Diphenyl Ethanedioat SCHEMBL10797780 0.83 TDP1 (0.50) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL43236 0.79 ELANE (0.52) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL9395495 0.79 ELANE (0.52) ELANETDP1ATML3MBTL1ALOX15
Acetic Acid Phenyl Ester SCHEMBL1309011 0.79 ELANE (0.67) ELANETDP1HPGDHSD17B10ALDH1A1
Diphenyl Ethanedioat SCHEMBL7064482 0.79 TDP1 (0.52) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL2164059 0.79 TDP1 (0.47) ELANETDP1ATML3MBTL1ALOX15
SCHEMBL27393432 0.79 TDP1 (0.47) ELANETDP1ATML3MBTL1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458834-B Diphenyl carbonate and method for producing same, catalyst and method for producing, recovering and reusing same, and polycarbonate 三菱化学株式会社 2019-10-25 CN disclosed
EP-0850928-B1 Novel peroxyoxalates derived from hydroxy-hydroperoxides ATOFINA CHEM INC (US) 2001-10-31 EP disclosed
EP-0850929-B1 Novel bis(mono- and diperoxy-oxalates) derived from dihydroperoxides and alkyl and alkylperoxy halooxalates ATOFINA CHEM INC (US) 2001-06-27 EP disclosed
EP-0850927-B1 Novel oxalic acid peroxide compositions and their uses ATOFINA CHEM INC (US) 2001-03-14 EP disclosed
US-5981787-A INITIATORS FOR POLYMERIZING ETHYLENICALLY UNSATURATED MONOMERS AND FOR CURING OF UNSATURATED POLYESTER RESINS ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-11-09 US disclosed
US-5866712-A POLYMERIZATION AND CURING CATALYSTS ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-02-02 US disclosed
US-5837782-A POLYMERIZATION CATALYST ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-11-17 US disclosed
EP-0850929-A1 Novel bis(mono- and diperoxy-oxalates) derived from dihydroperoxides and alkyl and alkylperoxy halooxalates ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-07-01 EP disclosed
EP-0850927-A1 Novel oxalic acid peroxide compositions and uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-07-01 EP disclosed
EP-0850928-A1 Novel peroxyoxalates derived from hydroxy-hydroperoxides ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-07-01 EP disclosed