SCHEMBL712263

SCHEMBL712263

C#Cc1ccc(C#Cc2cc(OC)cc(OC)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.52
ALDH1A1 P00352 1/20 0.44
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
KCNH2 Q12809 1/20 0.41
L3MBTL1 Q9Y468 4/20 0.39
TDP1 Q9NUW8 2/20 0.38
ATM Q13315 2/20 0.38
ABL1 P00519 1/20 0.38
ABCB1 P08183 1/20 0.38
BCR P11274 1/20 0.38
FFAR1 O14842 1/20 0.38
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
HCRTR1 O43613 1/20 0.36
CYP1A1 P04798 3/20 0.36

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
SCHEMBL709673 0.85 APP (0.63) APPCA12CA1CA2CA9
SCHEMBL673820 0.85 APP (0.69) APPALDH1A1CA12CA1CA2
SCHEMBL711441 0.83 ALDH1A1 (0.58) ALDH1A1CA12CA1CA2CA9
SCHEMBL674040 0.82 ALDH1A1 (0.65) APPALDH1A1CA12CA1CA2
SCHEMBL1005880 0.82 APP (0.77) APPALDH1A1ABL1ABCB1BCR
SCHEMBL16735426 0.78 ALDH1A1 (0.50) APPALDH1A1CA12CA1CA2
SCHEMBL187127 0.78 CA1 (0.58) APPALDH1A1CA12CA1CA2
SCHEMBL711936 0.77 APP (0.48) APPALDH1A1CA12CA1CA2
SCHEMBL30998834 0.76 CA1 (0.55) APPALDH1A1CA12CA1CA2
SCHEMBL21903457 0.76 APP (0.75) APPALDH1A1CA12CA1CA2

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