SCHEMBL18771832

SCHEMBL18771832

CCOC(=O)C1=Cc2ccc(-c3cccc(C(=O)N(C)C)c3)cc2N=C(N=NN)C1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 16/20 0.54
▸ TLR7 Q9NYK1 4/20 0.54

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
SCHEMBL18772107 0.92 TLR8 (0.50) TLR8TLR7
SCHEMBL12619295 0.87 TLR8 (0.70) TLR8TLR7
SCHEMBL18772200 0.85 TLR8 (0.50) TLR8TLR7
SCHEMBL18772042 0.84 TLR8 (0.49) TLR8TLR7
SCHEMBL18772121 0.83 TLR8 (0.52) TLR8TLR7
SCHEMBL19265669 0.81 TLR8 (0.49) TLR8TLR7
SCHEMBL10325435 0.80 TLR8 (0.59) TLR8TLR7
SCHEMBL18772071 0.79 TLR8 (0.46) TLR8TLR7
SCHEMBL18772214 0.79 TLR8 (0.68) TLR8TLR7
SCHEMBL11961332 0.78 TLR8 (0.65) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3159337-A2 SUBSTITUTED BENZOAZEPINES AS TOLL-LIKE RECEPTOR MODULATORS Ventirx Pharmaceuticals, Inc. (US) 2017-04-26 — — EP disclosed
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