SCHEMBL24344137

SCHEMBL24344137

CC(C)c1cnc2c(C3CCC3)c(CN(C)C)ccn2c1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.34
▸ AURKA O14965 1/20 0.34
▸ DAPK3 O43293 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ PRKD3 O94806 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ PAK4 O96013 1/20 0.34
▸ ABL1 P00519 1/20 0.34
▸ NTRK1 P04629 1/20 0.34
▸ LCK P06239 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ CSF1R P07333 1/20 0.34
▸ RET P07949 1/20 0.34
▸ IGF1R P08069 1/20 0.34
▸ MET P08581 1/20 0.34
▸ PDGFRB P09619 1/20 0.34
▸ PIM1 P11309 1/20 0.34
▸ FGFR1 P11362 1/20 0.34
▸ PDGFRA P16234 1/20 0.34
▸ PRKACA P17612 1/20 0.34

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
SCHEMBL24344175 0.85 CCNE1 (0.35) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL24345095 0.83 CHEK1 (0.34) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL17808726 0.79 CHEK1 (0.52) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL24345092 0.78 ALDH1A1 (0.41) ACVR1PDE4B
SCHEMBL24344150 0.77 ALDH1A1 (0.41) ACVR1
SCHEMBL24344399 0.76 GRM2 (0.38) FYNRETKDRBTKCLK4
SCHEMBL24344689 0.74 MAPT (0.33) PRKAA1
SCHEMBL17802288 0.72 CDK9 (0.47) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL17808731 0.71 CDK9 (0.46) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL24345035 0.71 PDE9A (0.41) —

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
EP-3227292-B1 4H-PYRIDO[1,2-a]PYRIMIDIN-4-ONE COMPOUNDS ALTERITY THERAPEUTICS LTD (AU) 2022-03-09 — — EP disclosed
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