SCHEMBL18771978

SCHEMBL18771978

CCOC(=O)C1=Cc2ccc(C3=CNCN=C3)cc2NC(N=NN)C1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.33
▸ TLR7 Q9NYK1 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
SCHEMBL18772038 0.86 TLR8 (0.37) TLR8TLR7
SCHEMBL18771963 0.83 MMP2 (0.41) TLR8TLR7
SCHEMBL18772070 0.81 TLR8 (0.31) TLR8TLR7
SCHEMBL18771974 0.80 MMP2 (0.45) TLR8TLR7
SCHEMBL18772117 0.80 KDM4E (0.39) TLR8TLR7
SCHEMBL18771933 0.80 TLR8 (0.34) TLR8TLR7
SCHEMBL18771997 0.80 TLR8 (0.45) TLR8TLR7
SCHEMBL18772002 0.79 HPGD (0.37) TLR8TLR7
SCHEMBL18772024 0.78 TLR8 (0.56) TLR8TLR7
SCHEMBL18772124 0.78 TLR8 (0.38) 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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