SCHEMBL25819571

SCHEMBL25819571

CCCCc1nc2c(NC(C)(C)C)nc3cc(C4=CCNCC4)sc3c2n1CC1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 8/20 0.41
TLR8 Q9NR97 2/20 0.37

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
SCHEMBL25819457 0.87 TLR7 (0.31) TLR7
SCHEMBL25294635 0.87 TLR7 (0.41) TLR7TLR8
SCHEMBL31270544 0.84 TLR7 (0.44) TLR7TLR8
SCHEMBL25254398 0.84 TLR7 (0.44) TLR7TLR8
SCHEMBL25819279 0.83 TLR7 (0.36) TLR7TLR8
SCHEMBL31025946 0.83 KIT (0.39) TLR7TLR8
SCHEMBL25257828 0.83 KIT (0.39) TLR7TLR8
SCHEMBL25255294 0.82 TLR7 (0.47) TLR7TLR8
SCHEMBL25254391 0.80 TLR7 (0.34) TLR7TLR8
SCHEMBL25297015 0.80 TLR7 (0.36) 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-2023125121-A1 TRICYCLIC COMPOUND, METHOD FOR PREPARING SAME, AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2023-07-06 WO disclosed