SCHEMBL711936

SCHEMBL711936

COc1cc(C#Cc2ccc(C#C[Si](C)(C)C)cc2)cc(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.48
ALDH1A1 P00352 1/20 0.41
GRM5 P41594 3/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
KCNH2 Q12809 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
ATM Q13315 2/20 0.37
FFAR1 O14842 1/20 0.36
ABL1 P00519 1/20 0.36
ABCB1 P08183 1/20 0.36
BCR P11274 1/20 0.36
HCRTR1 O43613 1/20 0.35

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
SCHEMBL673173 0.92 ALDH1A1 (0.48) APPALDH1A1GRM5L3MBTL1TDP1
SCHEMBL714294 0.86 APP (0.59) APPALDH1A1GRM5CA12CA1
SCHEMBL673162 0.84 APP (0.55) APPALDH1A1GRM5CA12CA1
SCHEMBL673820 0.82 APP (0.69) APPALDH1A1CA12CA1CA2
SCHEMBL674040 0.79 ALDH1A1 (0.65) APPALDH1A1GRM5CA12CA1
SCHEMBL1306505 0.79 APP (0.41) APPALDH1A1GRM5CYP1A2
SCHEMBL1005880 0.79 APP (0.77) APPALDH1A1ABL1ABCB1BCR
SCHEMBL852844 0.78 GRM5 (0.59) GRM5CA12CA1CA2CA9
SCHEMBL712263 0.77 APP (0.52) APPALDH1A1GRM5CA12CA1
SCHEMBL1306384 0.77 GABRA1 (0.38) APPALDH1A1GRM5CYP1A1CYP1A2

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