SCHEMBL31282006

SCHEMBL31282006

Cc1cc2cnn(C(=O)OC(C)(C)C)c2c(C)c1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.37
TAOK1 Q7L7X3 2/20 0.34
CLK4 Q9HAZ1 2/20 0.34
ROCK2 O75116 2/20 0.34
ROCK1 Q13464 2/20 0.34
EEF2K O00418 1/20 0.34
MAP4K4 O95819 1/20 0.34
CLK2 P49760 1/20 0.34
GSK3B P49841 1/20 0.34
PRKX P51817 1/20 0.34
NEK4 P51957 1/20 0.34
PRKG2 Q13237 1/20 0.34
PKN2 Q16513 1/20 0.34
AURKB Q96GD4 1/20 0.34
PBK Q96KB5 1/20 0.34
SLK Q9H2G2 1/20 0.34
MAP3K20 Q9NYL2 1/20 0.34
CHEK1 O14757 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33

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
SCHEMBL22796664 0.81 ELANE (0.40) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL31282833 0.80 KCNH2 (0.37) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL31283316 0.80 KCNH2 (0.37) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL31268155 0.77 ELANE (0.40) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL15639389 0.77 ELANE (0.40) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL3516273 0.76 EGFR (0.39) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL25293645 0.74 ELANE (0.43) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL30292229 0.74 ELANE (0.39) ELANEROCK2ROCK1CHEK2PRKACA
SCHEMBL8708836 0.73 ELANE (0.38) ELANETAOK1CLK4ROCK2ROCK1
SCHEMBL20348862 0.72 EGFR (0.43) ELANETAOK1CLK4ROCK2ROCK1

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-119371419-A PKMYT1 kinase inhibitors 杭州邦顺制药有限公司 2025-01-28 CN disclosed