SCHEMBL23855255

SCHEMBL23855255

N#Cc1ccc(N2C[C@@H](CN3CCC4(CC3)CC(=O)N4)O[C@@H](C(F)(F)F)C2)c2nccnc12

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 6/20 0.35
TLR9 Q9NR96 5/20 0.35
TLR7 Q9NYK1 5/20 0.35

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
SCHEMBL23855258 1.00 TLR8 (0.35) TLR8TLR9TLR7
SCHEMBL21661199 1.00 TLR8 (0.35) TLR8TLR9TLR7
SCHEMBL21661200 0.81 TLR8 (0.37) TLR8TLR9TLR7
SCHEMBL21661485 0.81 TLR8 (0.39) TLR8TLR9TLR7
SCHEMBL23855210 0.81 TLR8 (0.39) TLR8TLR9TLR7
SCHEMBL23855087 0.81 TLR8 (0.39) TLR8TLR9TLR7
SCHEMBL21645302 0.78 TLR8 (0.42) TLR8TLR9TLR7
SCHEMBL21645300 0.78 TLR8 (0.42) TLR8TLR9TLR7
SCHEMBL21645301 0.78 TLR8 (0.42) TLR8TLR9TLR7
SCHEMBL21645209 0.72 TLR8 (0.44) TLR8TLR9TLR7

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-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2021-09-30 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-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 TLR8 2/4885TLR9 3/4885TLR7 1/4885

“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.