SCHEMBL2589581

SCHEMBL2589581

CCCCOc1nc(N)c2[nH]c(=O)n(CCCN(CCN(C)C)Cc3ccccc3)c2n1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.66
IL6 P05231 3/20 0.56

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
SCHEMBL4132122 0.90 TLR7 (0.60) TLR7
SCHEMBL2589596 0.87 TLR7 (0.77) TLR7IL6
SCHEMBL4633208 0.87 TLR7 (0.53) TLR7
SCHEMBL13798674 0.87 TLR7 (0.71) TLR7
SCHEMBL2862789 0.87 TLR7 (0.60) TLR7
SCHEMBL3280954 0.86 TLR7 (0.61) TLR7IL6
SCHEMBL1146322 0.85 TLR7 (0.79) TLR7IL6
SCHEMBL1244619 0.85 TLR7 (0.62) TLR7
SCHEMBL1344514 0.84 TLR7 (0.66) TLR7IL6
SCHEMBL9935626 0.84 TLR7 (0.59) TLR7IL6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121693-B1 8-OXOADENINE DERIVATIVES AS IMMUNO-MODULATORS ASTRAZENECA AB (SE) 2012-08-08 EP claimed
US-8067411-B2 Compounds ASTRAZENECA AB (SE) 2011-11-29 US claimed
US-20080300244-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-12-04 US claimed
EP-2121693-B1 8-OXOADENINE DERIVATIVES AS IMMUNO-MODULATORS ASTRAZENECA AB (SE) 2012-08-08 EP disclosed
US-8067411-B2 Compounds ASTRAZENECA AB (SE) 2011-11-29 US disclosed
US-8067411-B2 Compounds ASTRAZENECA AB (SE) 2011-11-29 US disclosed
US-8067411-B2 Compounds ASTRAZENECA AB (SE) 2011-11-29 US disclosed
EP-2121693-A1 8-OXOADENINE DERIVATIVES AS IMMUNO-MODULATORS AstraZeneca AB (SE) 2009-11-25 EP disclosed
US-20080300244-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-12-04 US disclosed
US-20080300244-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-12-04 US disclosed
US-20080300244-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-12-04 US disclosed
WO-2008071976-A1 8-OXOADENINE DERIVATIVES AS IMMUNO-MODULATORS ASTRAZENECA AB (SE) 2008-06-19 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-20080300244-A1 NOVEL COMPOUNDS NPY1R, F12, NPY2R TLR7 3711/4885IL6 4407/4885

“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.