SCHEMBL30870441

SCHEMBL30870441

CCCCc1nc2c(N)nc3cc(CC(=O)OC)ccc3c2n1Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.64
TLR8 Q9NR97 5/20 0.64

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
SCHEMBL30870440 0.90 TLR7 (0.78) TLR7TLR8
SCHEMBL19196886 0.89 TLR7 (0.81) TLR7TLR8
SCHEMBL30870456 0.88 TLR7 (0.65) TLR7TLR8
SCHEMBL30870436 0.87 TLR7 (0.69) TLR7TLR8
SCHEMBL30870437 0.86 TLR7 (0.65) TLR7TLR8
SCHEMBL30870442 0.85 TLR7 (0.62) TLR7TLR8
SCHEMBL30870448 0.85 TLR7 (0.61) TLR7TLR8
SCHEMBL30870461 0.83 TLR7 (0.75) TLR7TLR8
SCHEMBL30870452 0.82 TLR7 (0.69) TLR7TLR8
SCHEMBL30870449 0.82 TLR7 (0.77) 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