SCHEMBL30870445

SCHEMBL30870445

CCCCc1nc2c(N)nc3cc(/C=C/C(=O)OC)ccc3c2n1Cc1ccc(CN)cc1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 18/20 0.72
▸ TLR8 Q9NR97 9/20 0.72

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
SCHEMBL30870435 0.87 TLR7 (0.62) TLR7TLR8
SCHEMBL4528140 0.86 TLR7 (0.66) TLR7TLR8
SCHEMBL30870440 0.84 TLR7 (0.78) TLR7TLR8
SCHEMBL19196890 0.84 TLR7 (1.00) TLR7TLR8
SCHEMBL26917876 0.81 TLR7 (0.82) TLR7TLR8
SCHEMBL30870449 0.79 TLR7 (0.77) TLR7TLR8
SCHEMBL19196887 0.77 TLR7 (0.87) TLR7TLR8
SCHEMBL19196883 0.77 TLR7 (0.87) TLR7TLR8
SCHEMBL30577190 0.77 TLR7 (1.00) TLR7TLR8
SCHEMBL13837354 0.77 TLR7 (1.00) TLR7TLR8

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
WO-2024112932-A1 IMMUNOMODULATORS AND IMMUNOMODULATOR CONJUGATES REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-05-30 — — WO disclosed
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