SCHEMBL19416368

SCHEMBL19416368

CCCN(OCc1ccccc1)C(=O)C1=Cc2ccc(-c3ccc(C=O)cc3)cc2N=C(N)C1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 20/20 0.53
▸ TLR7 Q9NYK1 5/20 0.53

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
SCHEMBL1589875 0.85 TLR8 (0.73) TLR8TLR7
SCHEMBL18771937 0.84 TLR8 (0.73) TLR8TLR7
SCHEMBL25692745 0.83 TLR8 (0.53) TLR8TLR7
SCHEMBL25692749 0.83 TLR8 (0.53) TLR8TLR7
SCHEMBL25692744 0.83 TLR8 (0.53) TLR8TLR7
SCHEMBL25682508 0.82 TLR8 (0.56) TLR8TLR7
SCHEMBL25689743 0.82 TLR8 (0.48) TLR8TLR7
SCHEMBL25692535 0.82 TLR8 (0.51) TLR8TLR7
SCHEMBL25681836 0.81 TLR8 (0.59) TLR8TLR7
SCHEMBL24516992 0.81 TLR8 (0.60) 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-3225623-A1 SUBSTITUTED BENZOAZEPINES AS TOLL-LIKE RECEPTOR MODULATORS Ventirx Pharmaceuticals, Inc. (US) 2017-10-04 — — EP disclosed
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