SCHEMBL7180218

SCHEMBL7180218

Cc1cccc(C)c1CCCOCCn1cnc2c(N)nc3ccccc3c21

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.54
ADORA2A P29274 2/20 0.54
LMNA P02545 2/20 0.54
POLB P06746 2/20 0.54
HRH2 P25021 1/20 0.54
ADRA1D P25100 1/20 0.54
HTR2A P28223 1/20 0.54
ADRA1A P35348 1/20 0.54
NUDT1 P36639 1/20 0.54
HTR2B P41595 1/20 0.54
PDE4D Q08499 1/20 0.54
KCNH2 Q12809 1/20 0.54
TLR8 Q9NR97 9/20 0.46
ADORA3 P0DMS8 1/20 0.42
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NCF1 P14598 1/20 0.40
PIK3CD O00329 1/20 0.40

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
SCHEMBL6107460 0.87 TLR7 (0.55) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6699331 0.86 TLR7 (0.54) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL4330880 0.85 TLR7 (0.59) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6730779 0.84 TLR7 (0.52) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6695790 0.84 TLR7 (0.51) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6694771 0.84 TLR7 (0.51) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6104970 0.83 TLR7 (0.51) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6702071 0.83 TLR7 (0.50) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL22043512 0.82 TLR7 (0.62) TLR7ADORA2ALMNAPOLBHRH2
SCHEMBL6105495 0.82 TLR7 (0.50) TLR7ADORA2ALMNAPOLBHRH2

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
EP-1341789-A2 ARYL ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2003-09-10 EP disclosed
WO-2002046189-A2 ARYL ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-06-13 WO disclosed