SCHEMBL1615487

SCHEMBL1615487

CCOCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)NC(=O)NC1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.63
TLR8 Q9NR97 13/20 0.63
NUDT1 P36639 1/20 0.63

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
SCHEMBL16905105 0.99 TLR7 (0.64) TLR7TLR8NUDT1
SCHEMBL3863672 0.93 TLR7 (0.53) TLR7TLR8NUDT1
SCHEMBL543801 0.89 TLR7 (0.65) TLR7TLR8NUDT1
SCHEMBL2744557 0.86 TLR7 (0.68) TLR7TLR8NUDT1
SCHEMBL5750439 0.85 TLR8 (0.56) TLR7TLR8NUDT1
SCHEMBL18204188 0.85 TLR7 (0.69) TLR7TLR8NUDT1
SCHEMBL15872116 0.85 TLR7 (0.59) TLR7TLR8NUDT1
SCHEMBL544499 0.84 TLR7 (0.41) TLR7TLR8NUDT1
SCHEMBL3863883 0.83 TLR7 (0.71) TLR7TLR8NUDT1
SCHEMBL29371111 0.83 TLR7 (0.71) TLR7TLR8NUDT1

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8961477-B2 Delivery of immune response modifier compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-02-24 US claimed
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
US-20170319712-A1 METHODS AND COMPOSITIONS FOR ENHANCING IMMUNE RESPONSE 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-11-09 US disclosed
US-9801947-B2 Methods and compositions for enhancing immune response 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-10-31 US disclosed
EP-3001990-A1 A MIXTURE FOR TRANSDERMAL DELIVERY OF LOW& AND HIGH MOLECULAR WEIGHT COMPOUNDS ORYXE (US) 2016-04-06 EP disclosed
EP-1765310-B1 A MIXTURE FOR TRANSDERMAL DELIVERY OF LOW AND HIGH MOLECULAR WEIGHT COMPOUNDS ORYXE (US) 2015-10-28 EP disclosed
US-8961477-B2 Delivery of immune response modifier compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-02-24 US disclosed
US-20150044279-A1 METHODS AND COMPOSITIONS FOR ENHANCING IMMUNE RESPONSE 3M INNOVATIVE PROPERTIES CO (US) 2015-02-12 US disclosed
US-20140200531-A1 MIXTURE FOR TRANSDERMAL DELIVERY OF LOW AND HIGH MOLECULAR WEIGHT COMPOUNDS JRX BIOTECHNOLOGY, INC. (US) 2014-07-17 US disclosed
WO-2005020912-A2 DELIVERY OF IMMUNE RESPONSE MODIFIER COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-03-10 WO disclosed
WO-2005016275-A2 FORMULATIONS CONTAINING AN IMMUNE RESPONSE MODIFIER 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-02-24 WO disclosed
US-20040265351-A1 Methods and compositions for enhancing immune response 3M INNOVATIVE PROPERTIES COMPANY 2004-12-30 US disclosed
US-20040258698-A1 Delivery of immune response modifier compounds 3M INNOVATIVE PROPERTIES COMPANY 2004-12-23 US disclosed
WO-2004108072-A2 DELIVERY OF IMMUNE RESPONSE MODIFIER COMPOUNDS USING METAL-CONTAINING PARTICULATE SUPPORT MATERIALS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-12-16 WO disclosed
WO-2004091500-A2 DELIVERY OF IMMUNE RESPONSE MODIFIER COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-10-28 WO disclosed
US-20040202720-A1 Delivery of immune response modifier compounds using metal-containing particulate support materials 3M INNOVATIVE PROPERTIES COMPANY 2004-10-14 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 (6 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-20040265351-A1 Methods and compositions for enhancing immune response LRBA, CD69, MYD88 TLR7 59/4885TLR8 60/4885NUDT1 3734/4885
US-20070292456-A1 Formulations Containing an Immune Response Modifier IFNG, IRF3, ICOS TLR7 18/4885TLR8 28/4885NUDT1 1398/4885
US-20040258698-A1 Delivery of immune response modifier compounds MIF, IRF3, CLEC4M TLR7 126/4885TLR8 51/4885NUDT1 4064/4885
US-20150044279-A1 METHODS AND COMPOSITIONS FOR ENHANCING IMMUNE RESPONSE LRBA, CD69, MYD88 TLR7 59/4885TLR8 60/4885NUDT1 3734/4885
US-20170319712-A1 METHODS AND COMPOSITIONS FOR ENHANCING IMMUNE RESPONSE LRBA, CD69, MYD88 TLR7 59/4885TLR8 60/4885NUDT1 3734/4885
US-20040202720-A1 Delivery of immune response modifier compounds using metal-containing particulate support materials MIF, IRF3, IRF2BP2 TLR7 131/4885TLR8 99/4885NUDT1 4048/4885

“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.