SCHEMBL699004

SCHEMBL699004

Clc1cccc(/C=C/c2ccccc2Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHAT P28329 2/20 0.51
CYP1A2 P05177 2/20 0.50
RELA Q04206 2/20 0.50
NFE2L2 Q16236 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP1A1 P04798 1/20 0.50
CYP1B1 Q16678 1/20 0.50
MAOB P27338 2/20 0.47
FBP1 P09467 1/20 0.47
CHRM5 P08912 1/20 0.47
TTR P02766 1/20 0.46
MAOA P21397 1/20 0.44
AKR1C3 P42330 1/20 0.44
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL699005 1.00 CHAT (0.51) CHATCYP1A2RELANFE2L2CYP2C9
SCHEMBL9156045 0.89 CYP1A2 (0.47) CHATCYP1A2RELANFE2L2CYP2C9
SCHEMBL699365 0.83 CHAT (0.67) CHATCYP1A2RELANFE2L2CYP2C9
SCHEMBL699364 0.83 CHAT (0.67) CHATCYP1A2RELANFE2L2CYP2C9
SCHEMBL6120528 0.81 CHAT (0.49) CHATCYP1A2RELANFE2L2CYP2C9
SCHEMBL8967768 0.81 TTR (0.59) CHATCYP1A2RELANFE2L2CYP1A1
SCHEMBL8967770 0.81 TTR (0.59) CHATCYP1A2RELANFE2L2CYP1A1
SCHEMBL6525705 0.81 CYP1A2 (0.51) CHATCYP1A2RELANFE2L2CYP2C9
SCHEMBL6120530 0.81 CHAT (0.49) CHATCYP1A2RELANFE2L2CYP2C9
SCHEMBL699875 0.81 CHAT (0.66) CHATCYP1A2RELANFE2L2CYP2C9

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