SCHEMBL31484545

SCHEMBL31484545

N#Cc1c(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1-c1ccncc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.37
MKNK1 Q9BUB5 1/20 0.37
ADORA2A P29274 1/20 0.37
PIK3CA P42336 1/20 0.36
SQOR Q9Y6N5 1/20 0.36
PRKACA P17612 1/20 0.35
CDK8 P49336 1/20 0.35
CLK2 P49760 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
CDK9 P50750 1/20 0.35
CDK5 Q00535 1/20 0.35
PRKCQ Q04759 1/20 0.35
ROCK1 Q13464 1/20 0.35
DYRK1A Q13627 1/20 0.35
LRRK2 Q5S007 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL31484547 0.87 MAPK14 (0.37) ADORA1ADORA2ASQORGSK3BMEN1
SCHEMBL19909016 0.86 ADORA1 (0.42) ADORA1MKNK1ADORA2APIK3CASQOR
SCHEMBL23343971 0.85 MAPK14 (0.36) ADORA1MKNK1ADORA2APIK3CASQOR
SCHEMBL31273268 0.84 MAPK14 (0.39) ADORA1MKNK1ADORA2APIK3CASQOR
SCHEMBL31272450 0.84 MAPK14 (0.39) ADORA1MKNK1ADORA2APIK3CASQOR
SCHEMBL25513109 0.84 PDE9A (0.37) ADORA1PDE9APDE1CKDM5B
SCHEMBL23344000 0.83 MAPK14 (0.39) ADORA1MKNK1ADORA2APIK3CASQOR
SCHEMBL23263911 0.83 ADORA1 (0.36) ADORA1PDE9APDE1CKDM5B
SCHEMBL20279077 0.83 ADORA1 (0.36) ADORA1PDE9APDE1CKDM5B
SCHEMBL19908876 0.82 SQOR (0.40) ADORA1MKNK1ADORA2APIK3CASQOR

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
CN-119899174-A Synthesis process of pyridine carbazole compound 南京师范大学 2025-04-29 CN disclosed