SCHEMBL28210774

SCHEMBL28210774

CCCCc1ccccc1N(N)c1cccc(CN)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 13/20 0.41
TLR7 Q9NYK1 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
AOC3 Q16853 1/20 0.33
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33
CSNK2A3 Q8NEV1 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
SCHEMBL28210771 0.89 TLR8 (0.37) TLR8AOC3
SCHEMBL28858410 0.84 LOXL2 (0.42) LOXL2CYP3A4CSNK2A2CSNK2BCSNK2A1
SCHEMBL28858466 0.79 HTR2A (0.40) TLR8AOC3
SCHEMBL11132556 0.78 LIPG (0.45) TLR8
SCHEMBL28858401 0.77 SKP2 (0.41) TLR8AOC3
SCHEMBL28210210 0.73 SIGMAR1 (0.49) LOXL2
SCHEMBL28858482 0.72 CSNK2A2 (0.42) LOXL2CSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL5809365 0.71 CYP3A4 (0.42) TLR8CYP3A4CYP2D6CYP2C9
SCHEMBL920929 0.70 LPL (0.49) TLR8LOXL2CYP3A4
SCHEMBL15345362 0.70 TLR8 (0.49) TLR8

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105985464-B Solid catalytic component for olefin polymerization and catalyst thereof 中国石油天然气股份有限公司 2018-04-03 CN claimed