SCHEMBL20009468

SCHEMBL20009468

CCCCCNc1nc(-c2cc(N)cnc2C)cnc1CCC

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 19/20 0.39
TLR7 Q9NYK1 10/20 0.39
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL22049710 0.65 TLR8 (0.45) TLR8TLR7L3MBTL1
SCHEMBL15127655 0.64 L3MBTL1 (0.44) TLR8TLR7L3MBTL1
SCHEMBL6166426 0.62 NPSR1 (0.39) TLR8TLR7L3MBTL1
SCHEMBL27631266 0.62 TLR8 (0.43) TLR8TLR7L3MBTL1
SCHEMBL4604967 0.61 KDM4E (0.35) TLR8
SCHEMBL6166433 0.61 S1PR2 (0.41) TLR8TLR7L3MBTL1
SCHEMBL16533905 0.61 PRMT5 (0.33)
SCHEMBL20341674 0.61 KMT2A (0.45) TLR8
SCHEMBL20219465 0.61 L3MBTL1 (0.61) TLR8TLR7L3MBTL1
SCHEMBL1194029 0.61 STK17A (0.49)

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
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed