SCHEMBL13952010

SCHEMBL13952010

N#Cc1cccc2c(C#N)c(C=Cc3ccc(N(c4ccc(C=O)cc4)c4cccc5ccccc45)cc3)ccc12

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ANPEP P15144 1/20 0.32
APP P05067 1/20 0.30
CHAT P28329 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
SCHEMBL12091213 0.90 MEN1 (0.36) CA1CA2ANPEPAPP
SCHEMBL10074380 0.90 ALDH1A1 (0.33) CA1CA2ANPEPAPPCHAT
SCHEMBL13952012 0.89 APP (0.34) CA1CA2APP
SCHEMBL13952011 0.88 APP (0.40) CA1CA2APP
SCHEMBL10074377 0.87 RELA (0.38)
SCHEMBL10074382 0.85 S100A4 (0.32) CA1CA2APP
SCHEMBL12310036 0.84 ALDH1A1 (0.35) APP
SCHEMBL12310017 0.82 CA1 (0.40) CA1CA2APPCHAT
SCHEMBL14436335 0.79 APP (0.40) CA1CA2APPCHAT
SCHEMBL12309956 0.79 RELA (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090039769-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS SONY CORPORATION (JP) 2009-02-12 US disclosed