SCHEMBL24539698

SCHEMBL24539698

CCCCc1nc2cnc3cc(Br)sc3c2n1Cc1ccc(CNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 17/20 0.47
TLR8 Q9NR97 6/20 0.41
AGTR1 P30556 1/20 0.40
AGTR2 P50052 1/20 0.40

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
SCHEMBL24539589 0.91 TLR7 (0.48) TLR7TLR8AGTR1AGTR2
SCHEMBL24539652 0.88 TLR7 (0.51) TLR7TLR8AGTR1AGTR2
SCHEMBL24539889 0.87 TLR7 (0.54) TLR7TLR8
SCHEMBL25256105 0.85 TLR7 (0.40) TLR7
SCHEMBL29136618 0.83 TLR7 (0.60) TLR7TLR8
SCHEMBL30824675 0.83 TLR7 (0.60) TLR7TLR8
SCHEMBL27197273 0.81 AGTR1 (0.42) TLR7TLR8AGTR1AGTR2
SCHEMBL24539231 0.81 TLR7 (0.50) TLR7TLR8
SCHEMBL31581270 0.80 TLR7 (0.55) TLR7TLR8
SCHEMBL25254941 0.78 CNR2 (0.32) TLR7AGTR1AGTR2

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-2022126263-A1 IMIDAZOTHIENOPYRIDINE COMPOUNDS AND METHODS OF USE ZYMEWORKS INC. (CA) 2022-06-23 WO disclosed