SCHEMBL700192

SCHEMBL700192

Ic1ccc(/C=C/c2ccccc2I)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.65
NFE2L2 Q16236 9/20 0.44
TRPA1 O75762 2/20 0.42
SIGMAR1 Q99720 1/20 0.39
RELA Q04206 2/20 0.38
CYP1A1 P04798 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP1B1 Q16678 2/20 0.38
FGF23 Q9GZV9 1/20 0.38
CYP19A1 P11511 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL700193 1.00 APP (0.65) APPNFE2L2TRPA1SIGMAR1RELA
SCHEMBL30533683 0.86 APP (0.63) APPNFE2L2TRPA1SIGMAR1CYP19A1
SCHEMBL5574063 0.86 APP (0.63) APPNFE2L2TRPA1SIGMAR1CYP19A1
SCHEMBL5574066 0.86 APP (0.63) APPNFE2L2TRPA1SIGMAR1CYP19A1
SCHEMBL29049176 0.83 NFE2L2 (0.66) APPNFE2L2RELAMAOAMAOB
SCHEMBL29049169 0.83 APP (0.61) APPNFE2L2TRPA1SIGMAR1CYP1A2
SCHEMBL10454309 0.83 APP (0.57) APPNFE2L2TRPA1SIGMAR1
SCHEMBL31122765 0.79 CYP19A1 (0.43) APPNFE2L2TRPA1RELACYP1A1
SCHEMBL699816 0.79 APP (0.56) APPNFE2L2TRPA1MAOAMAOB
SCHEMBL2949632 0.79 APP (1.00) APPRELAMAOAMAOB

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 18 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
CN-102399456-A Use of appended dyes in optical data storage media GEN ELECTRIC 2012-04-04 CN 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
CN-102005222-A Compositions, optical data storage media and methods for using the optical data storage media GEN ELECTRIC 2011-04-06 CN disclosed
CN-102005220-A Compositions, optical data storage media and methods for using the optical data storage media GEN ELECTRIC 2011-04-06 CN 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