SCHEMBL6669927

SCHEMBL6669927

CCOCc1nc2c(N)nc(C)c(C)c2n1CC(C)(C)NC(=O)N1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 16/20 0.41
TLR8 Q9NR97 13/20 0.41
NUDT1 P36639 1/20 0.41
HTT P42858 1/20 0.34
GAA P10253 1/20 0.33
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL6096708 0.84 TLR7 (0.49) TLR7TLR8NUDT1
SCHEMBL5027811 0.84 HTT (0.47) TLR7TLR8NUDT1HTTGAA
SCHEMBL2059131 0.83 HTT (0.48) TLR7TLR8NUDT1HTTGAA
SCHEMBL5617056 0.79 RAB9A (0.41) TLR7TLR8NUDT1HTTALDH1A1
SCHEMBL6674096 0.79 TLR7 (0.53) TLR7TLR8NUDT1
SCHEMBL6288804 0.78 TLR7 (0.41) TLR7TLR8NUDT1HTTGAA
SCHEMBL544499 0.78 TLR7 (0.41) TLR7TLR8NUDT1ALDH1A1
SCHEMBL6777973 0.78 TLR7 (0.37) TLR7TLR8NUDT1SMN1; SMN2
SCHEMBL6709510 0.77 TLR7 (0.52) TLR7TLR8NUDT1
SCHEMBL3869984 0.77 TLR7 (0.49) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451186-A2 UREA SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2004-09-01 EP claimed
US-20040157879-A1 Urea substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-08-12 US claimed
US-20030195209-A1 Urea substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2003-10-16 US claimed
US-20030176458-A1 Urea substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2003-09-18 US claimed
WO-2003050119-A2 UREA SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO claimed
US-6545017-B1 Inducing cytokine biosynthesis; treating a viral and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY 2003-04-08 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20030176458-A1 Urea substituted imidazopyridines EIF2AK2, UMPS, IRF3 TLR7 269/4885TLR8 341/4885NUDT1 30/4885
US-20030195209-A1 Urea substituted imidazopyridines EIF2AK2, UMPS, IRF3 TLR7 269/4885TLR8 341/4885NUDT1 30/4885
US-20040157879-A1 Urea substituted imidazopyridines EIF2AK2, UMPS, IRF3 TLR7 269/4885TLR8 341/4885NUDT1 30/4885

“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.