SCHEMBL4552672

SCHEMBL4552672

CCCCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)NS(C)(=O)=O

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.70
TLR8 Q9NR97 4/20 0.70

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
SCHEMBL544239 0.94 TLR7 (0.61) TLR7TLR8
SCHEMBL2744508 0.89 TLR7 (0.57) TLR7TLR8
SCHEMBL2744527 0.88 TLR7 (0.54) TLR7TLR8
SCHEMBL2744179 0.87 TLR7 (0.56) TLR7TLR8
SCHEMBL483278 0.87 TLR7 (0.68) TLR7TLR8
SCHEMBL30345824 0.87 TLR7 (0.68) TLR7TLR8
SCHEMBL29421427 0.86 TLR7 (0.73) TLR7TLR8
SCHEMBL1616712 0.86 TLR7 (0.73) TLR7TLR8
SCHEMBL29421426 0.86 TLR7 (0.73) TLR7TLR8
Water SCHEMBL4531043 0.85 TLR7 (0.72) TLR7TLR8

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-1651190-B1 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M INNOVATIVE PROPERTIES CO (US) 2012-09-19 EP claimed
EP-1651190-A4 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M INNOVATIVE PROPERTIES CO (US) 2009-07-15 EP claimed
US-20070292456-A1 Formulations Containing an Immune Response Modifier 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-12-20 US claimed
EP-1651190-A2 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M Innovative Properties Company (US) 2006-05-03 EP claimed
WO-2005016275-A2 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-02-24 WO claimed
EP-1651190-B1 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M INNOVATIVE PROPERTIES CO (US) 2012-09-19 EP disclosed
US-8221771-B2 Formulations containing an immune response modifier 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-07-17 US disclosed
EP-1651190-A4 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M INNOVATIVE PROPERTIES CO (US) 2009-07-15 EP disclosed
US-20070292456-A1 Formulations Containing an Immune Response Modifier 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-12-20 US disclosed
EP-1651190-A2 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M Innovative Properties Company (US) 2006-05-03 EP disclosed
US-20060051374-A1 Compositions and methods for mucosal vaccination 3M INNOVATIVE PROPERTIES COMPANY 2006-03-09 US disclosed
WO-2005016275-A2 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-02-24 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-20070292456-A1 Formulations Containing an Immune Response Modifier IFNG, IRF3, ICOS TLR7 18/4885TLR8 28/4885

“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.