SCHEMBL27860002

SCHEMBL27860002

CCCCc1cc2ccc3cccc4ccc(c1-c1ccc(CN)cc1)c2c34

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 12/20 0.44
CHEK1 O14757 1/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ERBB2 P04626 1/20 0.35
CYP1A2 P05177 1/20 0.35
FYN P06241 1/20 0.35
MAOA P21397 1/20 0.35
ACHE P22303 1/20 0.35
AHR P35869 1/20 0.35
ESR1 P03372 4/20 0.34
ESR2 Q92731 4/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL28874770 0.87 MEN1 (0.43) TLR8MEN1KMT2AERBB2CYP1A2
SCHEMBL28037112 0.80 TLR8 (0.49) TLR8CHEK1MEN1KMT2A
SCHEMBL4449698 0.80 PSMB5 (0.40) TLR8MEN1KMT2AERBB2CYP1A2
SCHEMBL27548748 0.78 TLR8 (0.44) TLR8ESR1ESR2
SCHEMBL2177707 0.76 MEN1 (0.47) TLR8CHEK1MEN1KMT2AERBB2
SCHEMBL11692367 0.76 HPGD (0.44) TLR8MEN1KMT2AERBB2CYP1A2
SCHEMBL660381 0.74 MEN1 (0.43) TLR8MEN1KMT2AERBB2CYP1A2
SCHEMBL28830926 0.74 PSMB5 (0.38) TLR8TSHR
SCHEMBL29743239 0.73 MEN1 (0.63) TLR8MEN1KMT2AERBB2CYP1A2
SCHEMBL719581 0.73 MEN1 (0.63) TLR8MEN1KMT2AERBB2CYP1A2

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
CN-103193697-B Light emitting element material and luminous element TORAY INDUSTRIES, INC. (JP) 2015-11-18 CN disclosed
CN-103193697-A Light-emitting device material and light-emitting device TORAY INDUSTRIES 2013-07-10 CN disclosed
CN-101258221-B Light-emitting device material and light-emitting device TORAY INDUSTRIES 2013-04-03 CN disclosed
CN-101258221-A Light-emitting device material and light-emitting device TORAY INDUSTRIES (JP) 2008-09-03 CN disclosed