SCHEMBL10194342

SCHEMBL10194342

[C-]#[N+]c1sc(N=Nc2c(C)nn(-c3nc(O)nc(-n4nc(C)c(N=Nc5nc(C)c(C#N)s5)c4N)n3)c2N)nc1C

nearest known ligand 0.30

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL10194341 0.85
SCHEMBL824602 0.77 MAPT (0.38) MEN1NPC1MAPTMAPK1RAB9A
SCHEMBL10194354 0.76
SCHEMBL10194343 0.72 MAPT (0.36) MEN1NPC1MAPTMAPK1RAB9A
SCHEMBL10194346 0.70
SCHEMBL10194258 0.70 MAPT (0.36) MEN1NPC1MAPTMAPK1RAB9A
SCHEMBL10194255 0.69 MAPT (0.37) MEN1NPC1MAPTMAPK1RAB9A
SCHEMBL10194337 0.69 MAPT (0.37) MEN1NPC1MAPTMAPK1RAB9A
SCHEMBL10194298 0.66 MAPT (0.46) MEN1NPC1MAPTMAPK1RAB9A
SCHEMBL10194359 0.66 NPC1 (0.36) MEN1NPC1MAPTMAPK1RAB9A

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