SCHEMBL30503527

SCHEMBL30503527

Fc1c[nH]c2nc(Br)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 2/20 0.46
CDK5R1 Q15078 2/20 0.46
CCNT1 O60563 1/20 0.46
CCNA2 P20248 1/20 0.46
CDK2 P24941 1/20 0.46
CDK9 P50750 1/20 0.46
CCNA1 P78396 1/20 0.46
ADORA2A P29274 4/20 0.40
ADORA1 P30542 3/20 0.36
AXL P30530 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
CLK1 P49759 1/20 0.32
CLK2 P49760 1/20 0.32
CLK3 P49761 1/20 0.32
DYRK1A Q13627 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
MAPK1 P28482 1/20 0.31
APP P05067 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
SCHEMBL26631464 1.00 CDK5 (0.46) CDK5CDK5R1CCNT1CCNA2CDK2
SCHEMBL28634050 0.79 AXL (0.52) CDK5CDK5R1CCNT1CCNA2CDK2
SCHEMBL5263827 0.77 KMT2A (0.54) CDK5CDK5R1CCNT1CCNA2CDK2
SCHEMBL15333269 0.76 CDK5 (0.46) CDK5CDK5R1CCNT1CCNA2CDK2
SCHEMBL29659275 0.76 ADORA2A (0.40) ADORA2AADORA1APP
SCHEMBL20455615 0.76 ADORA2A (0.40) ADORA2AADORA1APP
SCHEMBL20584686 0.76 CDK5 (0.54) CDK5CDK5R1CCNT1CCNA2CDK2
SCHEMBL21268783 0.76 CCNT1 (0.43) CDK5CDK5R1CCNT1CCNA2CDK2
SCHEMBL31365785 0.76 CCNT1 (0.43) CDK5CDK5R1CCNT1CCNA2CDK2
SCHEMBL13834754 0.72 LRRK2 (0.53) CDK5CDK5R1CCNT1CCNA2CDK2

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-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 CN disclosed