SCHEMBL30459718

SCHEMBL30459718

Cn1cc(-c2ccnc(Cl)n2)c2ccc(I)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.44
DYRK1B Q9Y463 3/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
EGFR P00533 6/20 0.36
HASPIN Q8TF76 1/20 0.35
CDK5 Q00535 2/20 0.34
CDK5R1 Q15078 2/20 0.34
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
GSK3B P49841 1/20 0.33
SCN9A Q15858 1/20 0.33
CDK2 P24941 2/20 0.33
DYRK3 O43781 1/20 0.33
IGF1R P08069 1/20 0.33
CLK1 P49759 1/20 0.33
CLK2 P49760 1/20 0.33
DYRK2 Q92630 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
DYRK4 Q9NR20 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
SCHEMBL17683321 1.00 DYRK1A (0.44) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL30337183 0.90 DYRK1A (0.41) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL28987580 0.90 DYRK1A (0.41) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL28384419 0.86 DYRK1A (0.46) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL30337162 0.86 DYRK1A (0.46) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL30337212 0.85 DYRK1A (0.45) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL19254846 0.85 DYRK1A (0.45) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL17490471 0.85 DYRK1A (0.45) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL28987593 0.82 DYRK1A (0.44) DYRK1ADYRK1BMKNK1MKNK2EGFR
SCHEMBL30337177 0.82 DYRK1A (0.44) DYRK1ADYRK1BMKNK1MKNK2EGFR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117402143-A EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2024-01-16 CN disclosed
CN-117069700-A EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-11-17 CN disclosed
CN-111187221-B EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-09-26 CN disclosed
CN-111171000-B EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-09-01 CN disclosed
CN-111170999-B EGFR inhibitor and preparation and application thereof 上海翰森生物医药科技有限公司 2023-06-30 CN disclosed