SCHEMBL17819059

SCHEMBL17819059

CCCCCn1c(N)nc2c(-c3ccccc3)cccc21

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 15/20 0.69
CXCR4 P61073 1/20 0.49
PDE4B Q07343 1/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL16486603 0.82 TLR8 (1.00) TLR8CXCR4PDE4BPOLB
SCHEMBL16486950 0.81 TLR8 (1.00) TLR8CXCR4TP53POLB
SCHEMBL16487216 0.80 TLR8 (1.00) TLR8CXCR4POLB
SCHEMBL16512953 0.80 TLR8 (0.74) TLR8CXCR4POLB
SCHEMBL16512951 0.80 TLR8 (0.74) TLR8CXCR4POLB
SCHEMBL16512962 0.80 TLR8 (1.00) TLR8CXCR4TP53POLB
SCHEMBL16512952 0.80 TLR8 (0.74) TLR8CXCR4POLB
SCHEMBL16512712 0.80 TLR8 (0.74) TLR8CXCR4TP53POLB
SCHEMBL16512958 0.77 TLR8 (0.71) TLR8CXCR4POLB
SCHEMBL16512961 0.77 TLR8 (1.00) TLR8CXCR4TP53POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10471139-B2 Toll-like receptor agonists THE UNIVERSITY OF KANSAS (US) 2019-11-12 US disclosed
US-20160166681-A1 TOLL-LIKE RECEPTOR AGONISTS THE UNIVERSITY OF KANSAS 2016-06-16 US disclosed
US-20160166681-A1 TOLL-LIKE RECEPTOR AGONISTS THE UNIVERSITY OF KANSAS 2016-06-16 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 (2 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-20160166681-A1 TOLL-LIKE RECEPTOR AGONISTS TLR1, TLR7, TLR8 TLR8 3/4885CXCR4 300/4885PDE4B 873/4885
US-10471139-B2 Toll-like receptor agonists TLR1, TLR7, TLR8 TLR8 3/4885CXCR4 300/4885PDE4B 873/4885

“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.