SCHEMBL28890453

SCHEMBL28890453

CCCCCC(CO)Nc1cc(N)nc2cccnc12

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 17/20 0.68
▸ TLR7 Q9NYK1 8/20 0.63
▸ PRMT5 O14744 1/20 0.44
▸ IDO1 P14902 1/20 0.40
▸ KCNH2 Q12809 1/20 0.39

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
SCHEMBL29958269 1.00 TLR8 (0.68) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL28959300 1.00 TLR8 (0.68) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL29956995 1.00 TLR8 (0.68) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL29957549 1.00 TLR8 (0.68) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL28890540 1.00 TLR8 (0.68) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL28890448 0.97 TLR8 (0.67) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL30949795 0.97 TLR8 (0.67) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL28890492 0.97 TLR8 (0.67) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL30949800 0.97 TLR8 (0.67) TLR8TLR7PRMT5IDO1KCNH2
SCHEMBL29236195 0.97 TLR8 (0.67) TLR8TLR7PRMT5IDO1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115362155-B Arylamine derivative, preparation method and medical application thereof 中国医药研究开发中心有限公司 2024-06-18 — — CN disclosed
CN-115362155-A Arylamine derivatives, and preparation method and medical application thereof 中国医药研究开发中心有限公司 2022-11-18 — — CN disclosed
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