SCHEMBL8136290

SCHEMBL8136290

NCCCCCCn1cnc2c(N)nc3ccccc3c21

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.62
LMNA P02545 1/20 0.62
POLB P06746 1/20 0.62
HRH2 P25021 1/20 0.62
ADRA1D P25100 1/20 0.62
HTR2A P28223 1/20 0.62
ADORA2A P29274 1/20 0.62
ADRA1A P35348 1/20 0.62
NUDT1 P36639 1/20 0.62
HTR2B P41595 1/20 0.62
PDE4D Q08499 1/20 0.62
KCNH2 Q12809 1/20 0.62
TLR8 Q9NR97 11/20 0.54

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
SCHEMBL3868909 1.00 TLR7 (0.62) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL8136496 1.00 TLR7 (0.62) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL3821194 0.99 TLR7 (0.63) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL8128122 0.95 TLR7 (0.64) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL3869660 0.89 TLR7 (0.67) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL10587620 0.89 TLR7 (0.64) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL3177482 0.89 TLR7 (0.64) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL15924735 0.89 TLR7 (0.64) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL5355612 0.88 TLR7 (0.63) TLR7LMNAPOLBHRH2ADRA1D
Hydrochloric Acid SCHEMBL3195878 0.88 TLR7 (0.62) TLR7LMNAPOLBHRH2ADRA1D

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-6069149-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS TERUMO KABUSHIKI KAISHA (JP) 2000-05-30 US disclosed
EP-0894797-A1 NOVEL AMIDE DERIVATIVES AND INTERMEDIATES FOR THE SYNTHESIS THEREOF TERUMO KABUSHIKI KAISHA (JP) 1999-02-03 EP disclosed