SCHEMBL10194306

SCHEMBL10194306

[C-]#[N+]c1cnn(-c2ccccc2)c1N=Nc1c(C)nn(-c2nc(N(C)C)nc(-n3nc(C)c(N=Nc4c(C#N)cnn4-c4ccccc4)c3N)n2)c1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.40
MAPT P10636 7/20 0.40
RAB9A P51151 7/20 0.40
TDP1 Q9NUW8 6/20 0.40
NPC1 O15118 6/20 0.40
MAPK1 P28482 5/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
LMNA P02545 3/20 0.37
GAA P10253 1/20 0.32
GLA P06280 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL1613519 0.95 SMN1; SMN2 (0.44) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL10194305 0.93 SMN1; SMN2 (0.42) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL1613303 0.92 SMN1; SMN2 (0.41) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL10194308 0.90 SMN1; SMN2 (0.40) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL10194331 0.86 MAPT (0.43) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL10194329 0.86 SMN1; SMN2 (0.39) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL10194295 0.85 SMN1; SMN2 (0.38) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL13388017 0.84 SMN1; SMN2 (0.36) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL10194332 0.84 MAPT (0.41) SMN1; SMN2MAPTRAB9ATDP1NPC1
SCHEMBL10052057 0.84 SMN1; SMN2 (0.48) SMN1; SMN2MAPTRAB9ATDP1NPC1

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