SCHEMBL25376383

SCHEMBL25376383

CCCCC(C)(CO)Nc1nc(N)nc2cc(-c3cc(=O)[nH]cc3CN(C)C)cnc12

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 16/20 0.58
▸ TLR7 Q9NYK1 7/20 0.52

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
SCHEMBL25376373 1.00 TLR8 (0.58) TLR8TLR7
SCHEMBL25375281 0.93 TLR8 (0.56) TLR8TLR7
SCHEMBL30563779 0.93 TLR8 (0.56) TLR8TLR7
SCHEMBL25375298 0.93 TLR8 (0.56) TLR8TLR7
SCHEMBL25375481 0.90 TLR8 (0.59) TLR8TLR7
SCHEMBL25375717 0.90 TLR8 (0.59) TLR8TLR7
SCHEMBL25375695 0.90 TLR8 (0.59) TLR8TLR7
SCHEMBL25377310 0.89 TLR8 (0.51) TLR8TLR7
SCHEMBL25377317 0.89 TLR8 (0.51) TLR8TLR7
SCHEMBL25377708 0.89 TLR8 (0.60) 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-2023160527-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG 广东东阳光药业股份有限公司 2023-08-31 — — WO disclosed
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