SCHEMBL714294

SCHEMBL714294

COc1ccc(C#Cc2ccc(C#C[Si](C)(C)C)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.59
KCNH2 Q12809 1/20 0.50
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA12 O43570 1/20 0.46
CA14 Q9ULX7 1/20 0.46
ACACB O00763 2/20 0.42
MCHR1 Q99705 2/20 0.42
HAO1 Q9UJM8 1/20 0.41
ACHE P22303 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM3 Q14832 1/20 0.39
GRM5 P41594 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL673162 0.98 APP (0.55) APPKCNH2CA1CA2CA7
SCHEMBL7994765 0.89 APP (0.47) APPKCNH2CA1CA2CA7
SCHEMBL10033154 0.87 APP (0.46) APPKCNH2CA1CA2CA7
SCHEMBL15441139 0.87 APP (0.46) APPKCNH2CA1CA2CA7
SCHEMBL711936 0.86 APP (0.48) APPKCNH2CA1CA2CA9
SCHEMBL15299057 0.85 APP (0.55) APPKCNH2CA1CA2CA7
SCHEMBL1306505 0.84 APP (0.41) APPMEN1ALDH1A1KMT2AGRM5
SCHEMBL10300057 0.84 APP (0.77) APPKCNH2CA1CA2CA7
SCHEMBL674764 0.84 APP (0.77) APPKCNH2CA1CA2CA7
SCHEMBL3846192 0.83 GRM5 (0.39) APPACACBHAO1MEN1ALDH1A1

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 6 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
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-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
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