SCHEMBL25684263

SCHEMBL25684263

CCCN(O)C(=O)C1=Cc2ccc(-c3ccc(C#N)nc3)cc2N=C(N)C1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 20/20 0.58
TLR7 Q9NYK1 5/20 0.58

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
SCHEMBL25684270 0.85 TLR8 (0.63) TLR8TLR7
SCHEMBL25681828 0.84 TLR8 (0.51) TLR8TLR7
SCHEMBL25684268 0.81 TLR8 (0.68) TLR8TLR7
SCHEMBL25684232 0.80 TLR8 (0.54) TLR8TLR7
SCHEMBL25684275 0.80 TLR8 (0.66) TLR8TLR7
SCHEMBL25683969 0.79 TLR8 (0.65) TLR8TLR7
SCHEMBL25684279 0.79 TLR8 (0.65) TLR8TLR7
SCHEMBL1803366 0.78 TLR8 (0.72) TLR8TLR7
SCHEMBL25683964 0.78 TLR8 (0.64) TLR8TLR7
SCHEMBL24507095 0.78 TLR8 (0.58) TLR8TLR7

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
WO-2023109944-A1 TLR MODULATOR AND USE THEREOF 映恩生物制药(苏州)有限公司 2023-06-22 WO disclosed