SCHEMBL10102121

SCHEMBL10102121

CCNc1cc(N)nc(N)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 3/20 0.47
AURKA O14965 1/20 0.46
PDPK1 O15530 1/20 0.46
TGFBR1 P36897 1/20 0.46
AURKB Q96GD4 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
PABPC1 P11940 1/20 0.44
RAB9A P51151 1/20 0.44
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
HRH4 Q9H3N8 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
NOS3 P29474 1/20 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
SCHEMBL6128303 0.82 TLR8 (0.69) TLR8AURKAPDPK1TGFBR1AURKB
SCHEMBL20434279 0.81 TLR8 (0.73) TLR8CYP2D6CYP2C19HRH4SMN1; SMN2
SCHEMBL6742818 0.80 TLR8 (0.45) TLR8AURKAPDPK1TGFBR1AURKB
SCHEMBL1318375 0.80 CYP2D6 (0.64) TLR8AURKAPDPK1TGFBR1AURKB
SCHEMBL13016990 0.80 PGK1 (0.39) TLR8AURKAPDPK1TGFBR1AURKB
Hydrochloric Acid SCHEMBL1900898 0.79 TLR8 (0.44) TLR8AURKAPDPK1TGFBR1AURKB
SCHEMBL29156884 0.78 TLR8 (0.64) TLR8CYP2D6CYP2C19HRH4
SCHEMBL30263108 0.78 TLR8 (0.64) TLR8CYP2D6CYP2C19HRH4
SCHEMBL7366748 0.78 CYP2D6 (0.47) TLR8MEN1KMT2ANPC1MAPT
SCHEMBL9182270 0.77 NUDT1 (0.66) TLR8AURKAPDPK1TGFBR1AURKB

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-8206465-B2 Azo pigments, pigment dispersion, coloring composition, and ink for inkjet recording FUJIFILM CORPORATION (JP) 2012-06-26 US disclosed
US-20110011306-A1 AZO PIGMENTS, PIGMENT DISPERSION, COLORING COMPOSITION, AND INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed