SCHEMBL10194367

SCHEMBL10194367

[C-]#[N+]c1cnn(-c2ncccn2)c1N=Nc1c(C)nn(-c2cncc(-n3nc(C)c(N=Nc4c(C#N)cnn4-c4ncccn4)c3N)n2)c1N

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
TDP1 Q9NUW8 2/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
GLA P06280 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL10194364 0.90 MAPT (0.34) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL10194365 0.90 MAPT (0.33) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL824558 0.83 MAPT (0.39) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL10194371 0.83 MAPT (0.45) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL10194329 0.83 SMN1; SMN2 (0.39) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL10194374 0.82 MAPT (0.45) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL10194373 0.82 MAPT (0.32) MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL10194314 0.81 MAPT (0.40) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL10194370 0.81 MAPT (0.43) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL824869 0.81 MAPT (0.53) MAPTNPC1RAB9ASMN1; SMN2TDP1

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-8118885-B2 Azo pigments, process for producing the azo pigments, and pigment dispersion, coloring composition and ink for inkjet recording containing the pigment FUJIFILM CORPORATION (JP) 2012-02-21 US disclosed
US-20110030583-A1 AZO PIGMENTS, PROCESS FOR PRODUCING THE AZO PIGMENTS, AND PIGMENT DISPERSION, COLORING COMPOSITION AND INK FOR INKJET RECORDING CONTAINING THE PIGMENT FUJIFILM COPORATION (JP) 2011-02-10 US disclosed