SCHEMBL10018087

SCHEMBL10018087

[C-]#[N+]/C(C#N)=C1/C/C(=C(\C#N)[N+]#[C-])c2cc(C)ccc21

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ USP8 P40818 1/20 0.31
▸ USP7 Q93009 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA4 P22748 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 1/20 0.30

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
SCHEMBL10018090 0.83 MEN1 (0.30) —
SCHEMBL10018079 0.82 ALDH1A1 (0.35) CA1CA9
SCHEMBL10018094 0.81 S100A4 (0.32) USP8USP7
SCHEMBL10018077 0.81 S100A4 (0.32) CA1CA2CA4CA7CA9
SCHEMBL10018080 0.81 USP8 (0.31) USP8USP7CA1CA2CA7
SCHEMBL10018078 0.81 NPC1 (0.34) —
SCHEMBL9970447 0.80 — —
SCHEMBL10018093 0.80 — —
SCHEMBL9961318 0.79 USP8 (0.33) USP8USP7CA1CA2CA4
SCHEMBL7045045 0.78 MAPT (0.39) USP8USP7CA1CA2CA4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8120019-B2 Organic light-emitting element having tetracyano compound and display device CANON KABUSHIKI KAISHA (JP) 2012-02-21 — — US disclosed
US-20090166615-A1 ORGANIC LIGHT-EMITTING ELEMENT AND DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 2009-07-02 — — US disclosed
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