SCHEMBL4131529

SCHEMBL4131529

CCCCOc1nc(N)c2[nH]c(=O)n(CCCN(CCCN3CCCC3)Cc3cccc(CC(=O)O)c3)c2n1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.66
TLR8 Q9NR97 1/20 0.51

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
SCHEMBL4132555 0.96 TLR7 (0.63) TLR7TLR8
SCHEMBL4131152 0.94 TLR7 (0.61) TLR7
SCHEMBL2837664 0.94 TLR7 (0.68) TLR7
Hydrochloric Acid SCHEMBL3360874 0.93 TLR7 (0.67) TLR7
Bromide SCHEMBL3363812 0.93 TLR7 (0.67) TLR7
SCHEMBL13798673 0.93 TLR7 (0.68) TLR7
SCHEMBL9935765 0.93 TLR7 (0.70) TLR7TLR8
SCHEMBL9936854 0.93 TLR7 (0.62) TLR7
SCHEMBL2390244 0.93 TLR7 (0.68) TLR7
SCHEMBL16256477 0.92 TLR7 (0.68) TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143400-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES ASTRAZENECA AB (SE) 2009-06-04 US claimed
EP-1928876-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES AstraZeneca AB (SE) 2008-06-11 EP claimed
WO-2007031726-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES ASTRAZENECA AB (SE) 2007-03-22 WO claimed
US-20090143400-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES ASTRAZENECA AB (SE) 2009-06-04 US disclosed
EP-1928876-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES AstraZeneca AB (SE) 2008-06-11 EP disclosed
WO-2007031726-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES ASTRAZENECA AB (SE) 2007-03-22 WO 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 (1 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-20090143400-A1 PURINE DERIVATIVES HAVING IMMUNO-MODULATING PROPERTIES IFNG, IFNAR1, IRF3 TLR7 101/4885TLR8 189/4885

“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.