SCHEMBL17181527

SCHEMBL17181527

CCOCc1nc2c(N)nc3ccc(OCCN)c(CC)c3c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 6/20 0.37
TLR7 Q9NYK1 5/20 0.35
NUDT1 P36639 1/20 0.30

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
SCHEMBL4070545 0.92 TLR8 (0.34) TLR8TLR7
SCHEMBL5805491 0.79 DCPS (0.38) TLR8TLR7
SCHEMBL4064967 0.76 TLR7 (0.34) TLR8TLR7
SCHEMBL4073451 0.76 TLR8 (0.31) TLR8TLR7NUDT1
SCHEMBL30662199 0.75 TLR8 (0.45) TLR8TLR7
SCHEMBL21712374 0.75 TLR8 (0.45) TLR8TLR7
SCHEMBL4068953 0.74 MTNR1A (0.33) TLR8TLR7
SCHEMBL21712361 0.74 NCF1 (0.39) TLR8TLR7
SCHEMBL30662172 0.74 NCF1 (0.39) TLR8TLR7
SCHEMBL5805143 0.73 TLR7 (0.42) TLR8TLR7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9447097-B2 4-amino-imidazoquinoline compounds HOFFMANN-LA ROCHE INC. (US) 2016-09-20 US disclosed
US-20160222010-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2016-08-04 US disclosed
US-9334268-B2 4-amino-imidazoquinoline compounds HOFFMAN-LA ROCHE INC. (US) 2016-05-10 US disclosed
US-20150299194-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2015-10-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160222010-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS TLR4, TLR1, TLR5 TLR8 9/4885TLR7 4/4885NUDT1 2019/4885
US-20150299194-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS TLR4, TLR1, TLR5 TLR8 9/4885TLR7 4/4885NUDT1 2019/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.