SCHEMBL7124016

SCHEMBL7124016

C=Cc1nc2c(N)nc3ccccc3c2n1CCOc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 9/20 0.49
TLR7 Q9NYK1 14/20 0.47
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
NUDT1 P36639 1/20 0.41

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
SCHEMBL6107457 0.81 TLR7 (0.50) TLR8TLR7TP53MAPT
SCHEMBL6106550 0.81 TLR8 (0.62) TLR8TLR7TP53MAPTSMN1; SMN2
SCHEMBL6103486 0.80 TLR8 (0.49) TLR8TLR7TP53MAPTSMN1; SMN2
SCHEMBL6107164 0.78 TLR7 (0.66) TLR8TLR7NUDT1
SCHEMBL6106004 0.78 TLR7 (0.60) TLR8TLR7
SCHEMBL6105409 0.77 HRH1 (0.50) TLR8TLR7
SCHEMBL6106367 0.77 TLR7 (0.63) TLR8TLR7
SCHEMBL6105631 0.77 TLR7 (0.73) TLR8TLR7
SCHEMBL6104415 0.75 TLR8 (0.63) TLR8TLR7TP53MAPTNUDT1
SCHEMBL6105703 0.75 TLR7 (0.52) TLR8TLR7TP53MAPT

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
US-6670372-B2 Immunomodulators, for inducing cytokine biosynthesis in animals, and in the treatment of viral and neoplastic diseases; imidazo(4,5-c) quinoline-4-amine compounds that have an ether containing substituent at the 1-position 3M INNOVATIVE PROPERTIES COMPANY 2003-12-30 US disclosed