SCHEMBL29824522

SCHEMBL29824522

Cc1nc(=O)c2cc(Br)cnc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
AURKA O14965 3/20 0.45
JAK2 O60674 3/20 0.45
MAP4K4 O95819 3/20 0.45
FGFR1 P11362 3/20 0.45
FLT1 P17948 3/20 0.45
KDR P35968 3/20 0.45
CLK2 P49760 3/20 0.45
CDK5 Q00535 3/20 0.45
MAP4K2 Q12851 3/20 0.45
DYRK1A Q13627 3/20 0.45
AURKB Q96GD4 3/20 0.45
CLK4 Q9HAZ1 3/20 0.45
PRKD3 O94806 2/20 0.45
TAOK1 Q7L7X3 2/20 0.45
DAPK3 O43293 2/20 0.45
PAK4 O96013 2/20 0.45
ABL1 P00519 2/20 0.45
RET P07949 2/20 0.45
PDGFRA P16234 2/20 0.45

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
SCHEMBL28960259 0.80 DYRK1A (0.45) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL23726765 0.76 AURKA (0.41) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL1192302 0.75 SMN1; SMN2 (0.53) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL31588150 0.75 SMN1; SMN2 (0.53) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL24659326 0.73 SMN1; SMN2 (0.60) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL30280407 0.72 CHEK1 (0.45) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL1565081 0.72 CHEK1 (0.45) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL7513614 0.72 CHEK1 (0.45) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL10131569 0.72 DYRK1A (0.46) SMN1; SMN2AURKAJAK2MAP4K4FGFR1
SCHEMBL6667192 0.71 LMNA (0.56) SMN1; SMN2AURKAJAK2MAP4K4FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116546985-A Pyridopyrimidine derivative and preparation method and application thereof 浙江海正药业股份有限公司 2023-08-04 CN disclosed
WO-2022160931-A1 PYRIDOPYRIMIDINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 浙江海正药业股份有限公司 2022-08-04 WO disclosed