SCHEMBL5068477

SCHEMBL5068477

CCCCCC(N)=O.CCOCc1nc2cnc3ccccc3c2n1CC(C)(C)NC(=O)CCCCCNC(=O)CCS

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.51
TLR8 Q9NR97 16/20 0.51
NUDT1 P36639 1/20 0.40

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
SCHEMBL4127741 0.95 TLR7 (0.53) TLR7TLR8NUDT1
SCHEMBL4769814 0.87 TLR7 (0.52) TLR7TLR8NUDT1
SCHEMBL4142764 0.85 TLR7 (0.60) TLR7TLR8NUDT1
SCHEMBL4129216 0.85 TLR7 (0.49) TLR7TLR8NUDT1
SCHEMBL4122028 0.85 TLR7 (0.48) TLR7TLR8NUDT1
SCHEMBL4134187 0.84 TLR7 (0.69) TLR7TLR8NUDT1
SCHEMBL4122208 0.82 TLR7 (0.48) TLR7TLR8NUDT1
SCHEMBL4124564 0.81 TLR7 (0.49) TLR7TLR8NUDT1
SCHEMBL5616958 0.80 TLR7 (0.49) TLR7TLR8
SCHEMBL18166856 0.79 TLR7 (0.44) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080193474-A1 Immunostimulatory Compositions 3M INNOVATIVE PROPERTIES COMPANY 2008-08-14 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 (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-20080193474-A1 Immunostimulatory Compositions CD47, ICOS, CD14 TLR7 69/4885TLR8 56/4885NUDT1 4424/4885

“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.