SCHEMBL28210771

SCHEMBL28210771

CCCCc1cccc(N(N)c2ccccc2CN)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.37
AOC3 Q16853 1/20 0.36
HTR1A P08908 1/20 0.36
LPL P06858 2/20 0.35
LIPG Q9Y5X9 2/20 0.35
SKP2 Q13309 1/20 0.35
DRD2 P14416 3/20 0.35
OPRM1 P35372 2/20 0.35
DRD3 P35462 2/20 0.35
OPRD1 P41143 2/20 0.35
OPRK1 P41145 2/20 0.35
SLC6A2 P23975 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL28210774 0.89 TLR8 (0.41) TLR8AOC3
SCHEMBL28858410 0.84 LOXL2 (0.42)
SCHEMBL28858401 0.80 SKP2 (0.41) TLR8AOC3HTR1ALPLLIPG
SCHEMBL28858466 0.76 HTR2A (0.40) TLR8AOC3HTR1ASKP2OPRM1
SCHEMBL15743670 0.73 LPL (0.49) AOC3HTR1ALPLLIPGDRD2
SCHEMBL11132556 0.72 LIPG (0.45) TLR8LIPG
SCHEMBL28210760 0.72 TP53 (0.38) SLC6A2SLC6A4
SCHEMBL10356301 0.71 LPL (0.46) LPLLIPGSKP2
SCHEMBL21120980 0.70 LPL (0.41) AOC3HTR1ALPLLIPGDRD2
SCHEMBL920929 0.70 LPL (0.49) TLR8LPLLIPGSKP2HTR2A

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