SCHEMBL5513634

SCHEMBL5513634

CCOCc1nc2c(N)nc3cccc(CCCCNCc4ccccc4)c3c2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.40
TLR8 Q9NR97 11/20 0.40
SIGMAR1 Q99720 3/20 0.36
DHFR P00374 1/20 0.35
BCHE P06276 2/20 0.35
MPO P05164 1/20 0.35

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
SCHEMBL23421089 0.85 TLR8 (0.34) TLR7TLR8DHFR
SCHEMBL18588106 0.84 TLR8 (0.42) TLR7TLR8DHFR
SCHEMBL23421520 0.79 TLR8 (0.33) TLR7TLR8
SCHEMBL17204268 0.77 TLR7 (0.45) TLR7TLR8
SCHEMBL4654594 0.77 TLR7 (0.39) TLR7TLR8
SCHEMBL5271662 0.75 TLR8 (0.43) TLR8DHFR
SCHEMBL23421036 0.75 TLR8 (0.33) TLR7TLR8DHFR
SCHEMBL20624057 0.74 TLR8 (0.40) TLR7TLR8
SCHEMBL4763415 0.74 TLR7 (0.49) TLR7TLR8
SCHEMBL23421518 0.73 TLR8 (0.37) TLR7TLR8DHFR

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-1850849-A2 METHOD OF PREFERENTIALLY INDUCING THE BIOSYNTHESIS OF INTERFERON Coley Pharmaceutical Group, Inc. (US) 2007-11-07 EP disclosed
WO-2006091647-A2 METHOD OF PREFERENTIALLY INDUCING THE BIOSYNTHESIS OF INTERFERON COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-08-31 WO disclosed