SCHEMBL6495047

SCHEMBL6495047

CCOCc1nc2c(N)nc3ccccc3c2n1CCCl

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 10/20 0.75
TLR7 Q9NYK1 18/20 0.72
NUDT1 P36639 1/20 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
Hydrochloric Acid SCHEMBL6502703 0.99 TLR8 (0.74) TLR8TLR7NUDT1
SCHEMBL4318872 0.92 TLR8 (0.71) TLR8TLR7NUDT1
SCHEMBL18179117 0.91 TLR7 (0.76) TLR8TLR7NUDT1
SCHEMBL25697382 0.91 TLR8 (0.78) TLR8TLR7NUDT1
SCHEMBL1616206 0.90 TLR8 (0.84) TLR8TLR7NUDT1
SCHEMBL6098914 0.90 TLR8 (0.77) TLR8TLR7NUDT1
SCHEMBL3868221 0.89 TLR8 (0.75) TLR8TLR7NUDT1
Hydrochloric Acid SCHEMBL6493853 0.89 TLR8 (0.82) TLR8TLR7NUDT1
Hydrochloric Acid SCHEMBL3863644 0.89 TLR8 (0.82) TLR8TLR7NUDT1
SCHEMBL28807387 0.89 TLR8 (0.75) TLR8TLR7NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916925-B1 Dye labeled imidazoquinoline compounds 3M INNOVATIVE PROPERTIES CO. (US) 2005-07-12 US disclosed
EP-1228147-B1 DYE LABELED IMIDAZOQUINOLINE COMPOUNDS 3M INNOVATIVE PROPERTIES CO (US) 2004-02-04 EP disclosed
US-6630588-B2 Imidazonaphthyridine, imidazopyridine and imidazoquinoline compounds that have immune response modulating activity and that contain a dye moiety, in particular, a fluorescent dye moiety, e.g., dipyrrometheneboron difluoride dyes 3M INNOVATIVE PROPERTIES COMPANY 2003-10-07 US disclosed
US-20020120141-A1 Dye labeled imidazoquinoline compounds 3M INNOVATIVE PROPERTIES COMPANY 2002-08-29 US disclosed
EP-1228147-A1 DYE LABELED IMIDAZOQUINOLINE COMPOUNDS 3M Innovative Properties Company (US) 2002-08-07 EP disclosed
US-6376669-B1 COMPLEXES 3M INNOVATIVE PROPERTIES COMPANY 2002-04-23 US disclosed
WO-2001034709-A1 DYE LABELED IMIDAZOQUINOLINE COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2001-05-17 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-20020120141-A1 Dye labeled imidazoquinoline compounds LY96, CD74, IFNAR1 TLR8 126/4885TLR7 41/4885NUDT1 579/4885

“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.