SCHEMBL30076206

SCHEMBL30076206

CCCC[C@](C)(CNC(C)=O)Nc1nc(N)nc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 11/20 0.52
▸ TLR7 Q9NYK1 4/20 0.52
▸ APP P05067 5/20 0.47
▸ KCNH2 Q12809 2/20 0.47
▸ CYP2D6 P10635 1/20 0.43

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
SCHEMBL19924171 1.00 TLR8 (0.52) TLR8TLR7APPKCNH2CYP2D6
SCHEMBL19924169 1.00 TLR8 (0.52) TLR8TLR7APPKCNH2CYP2D6
SCHEMBL19924202 0.87 CYP1A2 (0.41) TLR8TLR7APPCYP2D6
SCHEMBL30076201 0.87 CYP1A2 (0.41) TLR8TLR7APPCYP2D6
SCHEMBL19924198 0.87 CYP1A2 (0.41) TLR8TLR7APPCYP2D6
SCHEMBL23785473 0.87 TLR8 (0.51) TLR8TLR7APPKCNH2CYP2D6
SCHEMBL19924276 0.87 TLR8 (0.47) TLR8TLR7
SCHEMBL19924277 0.87 TLR8 (0.47) TLR8TLR7
SCHEMBL19924181 0.86 TLR8 (0.54) TLR8TLR7KCNH2
SCHEMBL19924183 0.86 TLR8 (0.54) TLR8TLR7KCNH2

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
CN-109923106-B toll-like receptor modulator compounds 吉利德科学公司 2022-09-13 — — CN disclosed
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