SCHEMBL30509482

SCHEMBL30509482

[2H]Cn1cc(Br)c(-c2ccc(F)cn2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 6/20 0.42
MAPK14 Q16539 5/20 0.42
FLT3 P36888 1/20 0.36
SYK P43405 1/20 0.36
AURKB Q96GD4 1/20 0.36
HTR1A P08908 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
TGFBR1 P36897 4/20 0.32
CSNK1A1 P48729 2/20 0.32
MAP4K4 O95819 1/20 0.32
EGFR P00533 1/20 0.32
FRK P42685 1/20 0.32
MAPK9 P45984 1/20 0.32
SLC34A1 Q06495 2/20 0.32
GRM5 P41594 5/20 0.32
CSNK1E P49674 1/20 0.31
TNIK Q9UKE5 1/20 0.31
KDR P35968 1/20 0.31
CYP1A2 P05177 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
SCHEMBL30509514 0.91 CSNK1D (0.42) CSNK1DMAPK14FLT3SYKAURKB
SCHEMBL25323855 0.89 CSNK1D (0.50) CSNK1DMAPK14FLT3SYKAURKB
SCHEMBL25323953 0.78 CSNK1D (0.38) CSNK1DMAPK14FLT3SYKAURKB
SCHEMBL25321487 0.77 NPC1 (0.41) CSNK1DMAPK14TGFBR1SLC34A1GRM5
SCHEMBL25325346 0.76 CSNK1D (0.36) CSNK1DMAPK14FLT3SYKAURKB
SCHEMBL25323918 0.73 CSNK1D (0.34) CSNK1DMAPK14FLT3SYKAURKB
SCHEMBL25323924 0.73 S1PR1 (0.36) CSNK1DMAPK14FLT3SYKAURKB
SCHEMBL25324809 0.72 CSNK1D (0.39) CSNK1DMAPK14FLT3SYKAURKB
SCHEMBL25324060 0.72 MAPK14 (0.36) CSNK1DMAPK14TGFBR1CSNK1EKDR
SCHEMBL25323906 0.72 SMN1; SMN2 (0.41) CSNK1DMAPK14GRM5KDR

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-116490503-A Casein kinase 1 delta modulators 詹森药业有限公司 2023-07-25 CN disclosed