SCHEMBL4742455

SCHEMBL4742455

CC(=O)Nc1cc(N(C)C)ccc1/N=N/c1c(C#N)cnn1-c1ncccn1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 13/20 0.36
RIOK2 Q9BVS4 1/20 0.35
STK4 Q13043 1/20 0.35
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HDAC1 Q13547 1/20 0.32

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
SCHEMBL4742428 0.88 KCNH2 (0.35) KCNH2RIOK2MAPTNPSR1MEN1
SCHEMBL4742501 0.85 KCNH2 (0.39) KCNH2RIOK2MAPTMEN1NPC1
SCHEMBL4742497 0.85 MAPT (0.40) KCNH2STK4PTGS1PTGS2MAPT
SCHEMBL4742451 0.84 NPC1 (0.42) STK4MAPTMEN1NPC1RAB9A
SCHEMBL4742439 0.82 ALDH1A1 (0.38) PTGS1PTGS2MAPTNPSR1MEN1
SCHEMBL4742453 0.80 ALDH1A1 (0.32) NPSR1NPC1RAB9AKMT2A
SCHEMBL4769994 0.80 IRAK4 (0.31) KCNH2MAPTNPSR1MEN1NPC1
SCHEMBL4743225 0.77 HPGD (0.34) STK4PTGS1PTGS2MAPTATM
SCHEMBL4742432 0.77 HPGD (0.34) STK4PTGS1PTGS2MAPTATM
SCHEMBL4742480 0.76 ALDH1A1 (0.39) STK4PTGS1PTGS2MAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8177861-B2 AZO pigment, pigment dispersion containing the AZO pigment, and coloring composition FUJIFILM CORPORATION (JP) 2012-05-15 US disclosed
US-8177861-B2 AZO pigment, pigment dispersion containing the AZO pigment, and coloring composition FUJIFILM CORPORATION (JP) 2012-05-15 US disclosed
US-20110021764-A1 AZO PIGMENT, PIGMENT DISPERSION CONTAINING THE AZO PIGMENT, AND COLORING COMPOSITION FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed
US-20110021764-A1 AZO PIGMENT, PIGMENT DISPERSION CONTAINING THE AZO PIGMENT, AND COLORING COMPOSITION FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed