SCHEMBL10101670

SCHEMBL10101670

[C-]#[N+]c1c(C(C)(C)C)n[nH]c1/N=N/c1c(C(C)(C)C)nn(-c2ccccc2)c1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.41
MAPT P10636 12/20 0.41
SMN1; SMN2 Q16637 11/20 0.41
NPC1 O15118 11/20 0.41
TDP1 Q9NUW8 8/20 0.41
HPGD P15428 5/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 8/20 0.40
NFKB1 P19838 4/20 0.40
NFKB2 Q00653 4/20 0.40
RELA Q04206 4/20 0.40
PLA2G1B P04054 2/20 0.40
ATG4B Q9Y4P1 2/20 0.40
MAPK1 P28482 5/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HTT P42858 2/20 0.38
ALOX12 P18054 1/20 0.38
GAA P10253 2/20 0.37

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
SCHEMBL12354932 0.87 ATM (0.32) MAPTTDP1HPGDALDH1A1LMNA
SCHEMBL12354943 0.81 PTGS2 (0.32) HPGDALDH1A1MEN1KMT2AGAA
SCHEMBL10101662 0.81 MAPT (0.37) RAB9AMAPTSMN1; SMN2NPC1TDP1
SCHEMBL12354958 0.81 NPC1 (0.32) RAB9ANPC1
SCHEMBL10106113 0.81 GAA (0.43) RAB9AMAPTSMN1; SMN2NPC1TDP1
SCHEMBL12354960 0.80 CA1 (0.35) MAPTTDP1HPGDLMNAMEN1
SCHEMBL92470 0.80 RAB9A (0.42) RAB9AMAPTSMN1; SMN2NPC1TDP1
SCHEMBL12439930 0.79 ALDH1A1 (0.34) MAPTSMN1; SMN2TDP1HPGDALDH1A1
SCHEMBL12354955 0.79
SCHEMBL12354946 0.78 MAPT (0.32) MAPTSMN1; SMN2NPC1TDP1HPGD

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-8092890-B2 Optical information recording medium, method of recording information, and azo metal complex dye FUJIFILM CORPORATION (JP) 2012-01-10 US disclosed
US-20080254252-A1 OPTICAL INFORMATION RECORDING MEDIUM, METHOD OF RECORDING INFORMATION, AND AZO METAL COMPLEX DYE FUJIFILM CORPORATION (JP) 2008-10-16 US disclosed