SCHEMBL25819166

SCHEMBL25819166

CCCCc1nc2c[n+](O)c3cc(Br)sc3c2n1CC1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 6/20 0.45
TLR8 Q9NR97 1/20 0.40
CNR2 P34972 11/20 0.35
CNR1 P21554 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL25301990 0.89 TLR7 (0.45) TLR7TLR8CNR2CNR1
SCHEMBL25819220 0.82 GLS (0.37)
SCHEMBL25301816 0.81 TLR7 (0.48) TLR7TLR8CNR2BRD4
SCHEMBL31270883 0.79 TLR7 (0.46) TLR7TLR8CNR2BRD4
SCHEMBL25255323 0.79 TLR7 (0.46) TLR7TLR8CNR2BRD4
SCHEMBL25818897 0.78 TLR7 (0.45) TLR7TLR8CNR2CNR1BRD4
SCHEMBL25301552 0.73 RORC (0.37) CNR2
SCHEMBL25255294 0.73 TLR7 (0.47) TLR7TLR8CNR2
SCHEMBL30484321 0.73 TLR7 (0.48) TLR7TLR8CNR2BRD4
SCHEMBL25300018 0.73 TLR7 (0.48) TLR7TLR8CNR2BRD4

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