SCHEMBL10106113

SCHEMBL10106113

CC(C)(C)c1n[nH]c(/N=N/c2c(C(C)(C)C)nn(-c3ccccc3)c2N)c1C#N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
MAPT P10636 14/20 0.41
RAB9A P51151 10/20 0.41
NPC1 O15118 9/20 0.41
SMN1; SMN2 Q16637 9/20 0.41
TDP1 Q9NUW8 6/20 0.41
HPGD P15428 4/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 7/20 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 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
ALOX12 P18054 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL12363889 0.87 ATM (0.34) GAAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL12514579 0.83 GAA (0.33) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL15958685 0.81 MEN1 (0.32) GAAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL10105984 0.81 MAPT (0.39) GAAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL12363234 0.81 KDM4E (0.36) GAAMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL12363684 0.81 KDM4E (0.32) GAAMAPTRAB9ANPC1HPGD
SCHEMBL14227468 0.81
SCHEMBL10101670 0.81 RAB9A (0.41) GAAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL12636843 0.81
SCHEMBL12362880 0.80 GRM5 (0.36) MAPTALDH1A1MEN1KMT2AHTT

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 4 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-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-20080254252-A1 OPTICAL INFORMATION RECORDING MEDIUM, METHOD OF RECORDING INFORMATION, AND AZO METAL COMPLEX DYE FUJIFILM CORPORATION (JP) 2008-10-16 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