SCHEMBL699770

SCHEMBL699770

Clc1ccc(/C=C/c2ccccc2Cl)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 3/20 0.66
CYP1A2 P05177 2/20 0.65
CYP1A1 P04798 1/20 0.65
CYP1B1 Q16678 1/20 0.65
RELA Q04206 1/20 0.65
CHAT P28329 1/20 0.61
AHR P35869 1/20 0.50
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
ALDH1A1 P00352 4/20 0.46
MAOB P27338 2/20 0.46
MAOA P21397 1/20 0.46
KDM4E B2RXH2 3/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL699771 1.00 NFE2L2 (0.66) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL10458456 0.89 NFE2L2 (0.73) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL10458930 0.89 NFE2L2 (0.73) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL11468743 0.88 NFE2L2 (0.52) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL5493438 0.86 CHAT (0.66) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL5493433 0.86 CHAT (0.66) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL23332267 0.83 NFE2L2 (0.66) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL1058814 0.83 ALDH1A1 (0.62) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL10707196 0.83 NFE2L2 (0.61) NFE2L2CYP1A2CYP1A1CYP1B1RELA
SCHEMBL10707190 0.83 NFE2L2 (0.61) NFE2L2CYP1A2CYP1A1CYP1B1RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8703388-B2 Optical data storage media GENERAL ELECTRIC COMPANY (US) 2014-04-22 US disclosed
US-8507153-B2 Compositions, optical data storage media and methods for using the optical data storage media GENERAL ELECTRIC COMPANY (US) 2013-08-13 US disclosed
EP-2423917-B1 Use of chemically bonded dyes in holographic data storage media GEN ELECTRIC (US) 2013-08-07 EP disclosed
US-8343608-B2 Use of appended dyes in optical data storage media GENERAL ELECTRIC COMPANY (US) 2013-01-01 US disclosed
EP-2290651-B1 Compositions, optical data storage media and methods for using the optical data storage media GEN ELECTRIC (US) 2012-10-10 EP disclosed
EP-2290408-B1 Compositions, optical data storage media and methods for using the optical data storage media GEN ELECTRIC (US) 2012-08-15 EP disclosed
US-20120163145-A1 OPTICAL DATA STORAGE MEDIA GENERAL ELECTRIC COMPANY (US) 2012-06-28 US disclosed
US-20120052232-A1 USE OF APPENDED DYES IN OPTICAL DATA STORAGE MEDIA GENERAL ELECTRIC COMPANY (US) 2012-03-01 US disclosed
EP-2423917-A2 Use of chemically bonded dyes in holographic data storage media General Electric Company (US) 2012-02-29 EP disclosed
US-8124299-B2 Methods for using optical data storage media GENERAL ELECTRIC COMPANY (US) 2012-02-28 US disclosed
US-20110053054-A1 COMPOSITIONS, OPTICAL DATA STORAGE MEDIA AND METHODS FOR USING THE OPTICAL DATA STORAGE MEDIA GENERAL ELECTRIC COMPANY (US) 2011-03-03 US disclosed
US-20110053055-A1 COMPOSITIONS, OPTICAL DATA STORAGE MEDIA AND METHODS FOR USING THE OPTICAL DATA STORAGE MEDIA GENERAL ELECTRIC COMPANY (US) 2011-03-03 US disclosed
EP-2290408-A1 Compositions, optical data storage media and methods for using the optical data storage media General Electric Company (US) 2011-03-02 EP disclosed
EP-2290651-A1 Compositions, optical data storage media and methods for using the optical data storage media General Electric Company (US) 2011-03-02 EP disclosed
US-20100302927-A1 OPTICAL DATA STORAGE MEDIUM AND METHODS FOR USING THE SAME GENERAL ELECTRIC COMPANY (US) 2010-12-02 US disclosed