SCHEMBL27657269

SCHEMBL27657269

CCOCc1nc2cnc3cc(O)ccc3c2n1CCCCOC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 12/20 0.36
TLR7 Q9NYK1 18/20 0.35
NUDT1 P36639 1/20 0.33

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
SCHEMBL6248929 0.91 TLR7 (0.42) TLR8TLR7NUDT1
SCHEMBL27657384 0.86 TLR7 (0.39) TLR8TLR7
SCHEMBL4247998 0.83 TLR7 (0.39) TLR8TLR7NUDT1
SCHEMBL29263606 0.82 TLR7 (0.40) TLR8TLR7NUDT1
SCHEMBL4247851 0.80 TLR7 (0.46) TLR8TLR7
SCHEMBL4247587 0.79 PDCD1 (0.34) TLR8TLR7NUDT1
SCHEMBL4491917 0.79 MAPT (0.44) TLR8TLR7
SCHEMBL27640490 0.78 NMT1 (0.40)
SCHEMBL5616943 0.78 TLR8 (0.46) TLR8TLR7NUDT1
SCHEMBL4247584 0.78 TLR7 (0.32) TLR8TLR7NUDT1

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-1897948-A Alkoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES CO (US) 2007-01-17 CN disclosed