SCHEMBL25820344

SCHEMBL25820344

CCCCc1nc2c(N)nc3cc(C4CCN(C(=O)CCOCCOCCOCCOCCOCCOCCOCCNC(=O)OC(C)(C)C)CC4)sc3c2n1CC1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.44
TLR8 Q9NR97 3/20 0.40
P2RY14 Q15391 1/20 0.39

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
SCHEMBL31270620 1.00 TLR7 (0.44) TLR7TLR8P2RY14
SCHEMBL31270949 0.99 TLR7 (0.45) TLR7TLR8P2RY14
SCHEMBL25820585 0.99 TLR7 (0.45) TLR7TLR8P2RY14
SCHEMBL31270869 0.90 TLR7 (0.42) TLR7TLR8
SCHEMBL25820109 0.90 TLR7 (0.43) TLR7TLR8
SCHEMBL25818922 0.90 TLR7 (0.43) TLR7TLR8P2RY14
SCHEMBL31270800 0.90 TLR7 (0.43) TLR7TLR8P2RY14
SCHEMBL25301523 0.89 TLR7 (0.49) TLR7TLR8
SCHEMBL25301818 0.88 TLR7 (0.50) TLR7TLR8
SCHEMBL25820997 0.85 TLR7 (0.41) TLR7

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