SCHEMBL4301096

SCHEMBL4301096

CCc1nc2c(N)nc3ccc(CCCN)nc3c2n1N

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.42
TLR8 Q9NR97 4/20 0.42
DHFR P00374 6/20 0.41

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
SCHEMBL4301098 0.77 TLR7 (0.36) TLR7TLR8
SCHEMBL5410261 0.76 TLR8 (0.46) TLR7TLR8
SCHEMBL5410266 0.72 TLR7 (0.43) TLR7TLR8
SCHEMBL4753166 0.65 TLR8 (0.48) TLR7TLR8
SCHEMBL20134736 0.65 DHFR (0.67) DHFR
SCHEMBL6807516 0.64 PI4KA (0.41) TLR7TLR8DHFR
SCHEMBL18587594 0.64 TLR7 (0.75) TLR7TLR8
SCHEMBL18109747 0.64 DHFR (0.69) DHFR
SCHEMBL3863988 0.63 TLR7 (0.81) TLR7TLR8
Hydrochloric Acid SCHEMBL30503496 0.63 TLR7 (0.79) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS IL2, IL4I1, IFNG TLR7 188/4885TLR8 208/4885DHFR 157/4885

“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.