SCHEMBL27901656

SCHEMBL27901656

NCc1cc(Br)cc(Nc2nccc(C(F)F)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.39
CLK1 P49759 2/20 0.35
CLK2 P49760 2/20 0.35
DYRK1A Q13627 2/20 0.35
CLK4 Q9HAZ1 2/20 0.35
DYRK1B Q9Y463 2/20 0.35
CDK2 P24941 3/20 0.34
CDK4 P11802 1/20 0.34
CFD P00746 1/20 0.33
CCNA2 P20248 1/20 0.33
CCNA1 P78396 1/20 0.33
CDK9 P50750 1/20 0.32
KDR P35968 2/20 0.32
PIK3CA P42336 2/20 0.32
PIK3CG P48736 2/20 0.32
PIK3CB P42338 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL2017518 0.81 PIK3CA (0.44) SYKCDK2CDK4KDRPIK3CA
SCHEMBL27901705 0.80 SYK (0.61) SYKLOXL2
SCHEMBL16876362 0.78 SYK (0.54) SYKCDK2CCNA2CCNA1KDR
SCHEMBL2014313 0.69 PIK3CA (0.45) SYKCDK2CDK4KDRPIK3CA
SCHEMBL16205292 0.68 KDR (0.42) SYKCDK2CDK4KDRPIK3CA
SCHEMBL2504479 0.68 SYK (0.46) SYKCDK2KDRPIK3CAPIK3CG
SCHEMBL2016999 0.67 SYK (0.65) SYK
SCHEMBL16876324 0.67 PIK3CA (0.43) SYKCDK2KDRPIK3CAPIK3CG
SCHEMBL2498437 0.66 SYK (0.53) SYK
SCHEMBL2014905 0.66 SYK (0.56) SYK

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-102858767-A Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME 2013-01-02 CN disclosed