SCHEMBL12330866

SCHEMBL12330866

Cc1nc(Cl)nc(NCCC=O)c1C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 2/20 0.38
▸ TLR7 Q9NYK1 1/20 0.38
▸ PDE10A Q9Y233 1/20 0.32

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
SCHEMBL12330925 0.75 TLR8 (0.47) TLR8TLR7PDE10A
SCHEMBL12330861 0.75 TLR8 (0.46) TLR8TLR7PDE10A
SCHEMBL6415271 0.75 TLR8 (0.58) TLR8TLR7PDE10A
SCHEMBL15764603 0.74 LMNA (0.48) TLR8TLR7PDE10A
SCHEMBL12330648 0.72 TLR8 (0.44) TLR8TLR7
SCHEMBL12331682 0.71 TLR8 (0.36) TLR8TLR7PDE10A
SCHEMBL27987862 0.71 LMNA (0.43) —
SCHEMBL12330986 0.70 ACHE (0.47) TLR8TLR7
SCHEMBL29698841 0.70 APP (0.62) —
SCHEMBL12330926 0.69 TLR8 (0.38) TLR8TLR7PDE10A

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-2011115183-A1 NOVEL MONOCYCLIC PYRIMIDINE DERIVATIVE 大日本住友製薬株式会社 (JP) 2011-09-22 — — WO disclosed
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