SCHEMBL24344175

SCHEMBL24344175

CN(C)Cc1ccn2c(=O)c(C3CCCC3)cnc2c1C1CCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 7/20 0.35
▸ CDK2 P24941 7/20 0.35
▸ CDK9 P50750 2/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ AURKA O14965 1/20 0.35
▸ DAPK3 O43293 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ PRKD3 O94806 1/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ PAK4 O96013 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ LCK P06239 1/20 0.35
▸ FYN P06241 1/20 0.35
▸ CSF1R P07333 1/20 0.35
▸ RET P07949 1/20 0.35
▸ IGF1R P08069 1/20 0.35
▸ MET P08581 1/20 0.35
▸ PDGFRB P09619 1/20 0.35
▸ PIM1 P11309 1/20 0.35

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
SCHEMBL17802288 0.86 CDK9 (0.47) CCNE1CDK2CDK9CHEK1AURKA
SCHEMBL17808731 0.85 CDK9 (0.46) CCNE1CDK2CDK9CHEK1AURKA
SCHEMBL24344137 0.85 CHEK1 (0.34) CDK9CHEK1AURKADAPK3JAK2
SCHEMBL24345095 0.84 CHEK1 (0.34) CCNE1CDK2CDK9CHEK1AURKA
SCHEMBL24345092 0.81 ALDH1A1 (0.41) ACVR1
SCHEMBL24344150 0.80 ALDH1A1 (0.41) ACVR1
SCHEMBL24344399 0.77 GRM2 (0.38) FYNRETKDRBTKCLK4
SCHEMBL24345063 0.71 CCNE1 (0.39) CCNE1CDK2CDK9CCNT1CDK1
SCHEMBL17808769 0.68 CCNE1 (0.41) CCNE1CDK2CDK9CCNT1CDK1
SCHEMBL17802284 0.67 CCNE1 (0.42) CCNE1CDK2CDK9CCNT1CDK1

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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