SCHEMBL12636726

SCHEMBL12636726

CC(C)(C)c1nn(-c2c(Cl)cc(Cl)cc2Cl)c(/N=N/c2c(C(C)(C)C)nn(-c3ccccc3)c2N)c1C#N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.41
RAB9A P51151 10/20 0.41
SMN1; SMN2 Q16637 10/20 0.41
NPC1 O15118 9/20 0.41
TDP1 Q9NUW8 6/20 0.41
MAPK1 P28482 6/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALOX12 P18054 1/20 0.41
HTT P42858 1/20 0.41
GAA P10253 3/20 0.39
KDM4E B2RXH2 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HPGD P15428 4/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 6/20 0.36
NFKB1 P19838 4/20 0.36
NFKB2 Q00653 4/20 0.36
RELA Q04206 4/20 0.36

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
SCHEMBL12636700 0.83 GAA (0.44) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL12636709 0.81 GAA (0.46) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL13310786 0.80 GAA (0.42) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL12636701 0.79 GAA (0.45) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL12636703 0.79 ALDH1A1 (0.44) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL12636706 0.77 GAA (0.43) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL12636711 0.77 MAPT (0.40) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL12636723 0.77 GAA (0.38) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL10106113 0.74 GAA (0.43) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL2743087 0.74 GAA (0.61) MAPTRAB9ASMN1; SMN2NPC1MEN1

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-7947625-B2 Ink sheet for heat-sensitive transfer recording material, heat-sensitive transfer recording method, ink cartridge and azo dye FUJIFILM CORPORATION (JP) 2011-05-24 US disclosed
US-20070202282-A1 Ink sheet for heat-sensitive transfer recording material, heat-sensitive transfer recording method, ink cartridge and azo dye FUJIFILM CORPORATION (JP) 2007-08-30 US disclosed