SCHEMBL19641804

SCHEMBL19641804

CCCN(CCC)C(=O)C1=Cc2ccc(C(=O)N3CCC[C@H](Nc4ccccc4)C3)cc2N=C(N)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 20/20 1.00
▸ TLR7 Q9NYK1 17/20 1.00

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
SCHEMBL19651888 1.00 TLR8 (1.00) TLR8TLR7
SCHEMBL19651954 0.95 TLR8 (1.00) TLR8TLR7
SCHEMBL19641830 0.93 TLR8 (1.00) TLR8TLR7
SCHEMBL19651939 0.91 TLR8 (1.00) TLR8TLR7
SCHEMBL19651890 0.90 TLR8 (1.00) TLR8TLR7
SCHEMBL24699640 0.88 TLR8 (0.79) TLR8TLR7
SCHEMBL30822808 0.88 TLR8 (0.79) TLR8TLR7
SCHEMBL19641892 0.88 TLR8 (1.00) TLR8TLR7
SCHEMBL19651977 0.88 TLR8 (1.00) TLR8TLR7
SCHEMBL30822795 0.87 TLR8 (0.76) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464245-A1 BENZAZEPINE DICARBOXAMIDE COMPOUNDS WITH TERTIARY AMIDE FUNCTION H. Hoffnabb-La Roche Ag (CH) 2019-04-10 — — EP claimed
WO-2017202704-A1 BENZAZEPINE DICARBOXAMIDE COMPOUNDS WITH TERTIARY AMIDE FUNCTION F. HOFFMANN-LA ROCHE AG (CH) 2017-11-30 — — WO claimed
EP-3464245-A1 BENZAZEPINE DICARBOXAMIDE COMPOUNDS WITH TERTIARY AMIDE FUNCTION H. Hoffnabb-La Roche Ag (CH) 2019-04-10 — — EP disclosed
WO-2017202704-A1 BENZAZEPINE DICARBOXAMIDE COMPOUNDS WITH TERTIARY AMIDE FUNCTION F. HOFFMANN-LA ROCHE AG (CH) 2017-11-30 — — WO disclosed
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