SCHEMBL5244617

SCHEMBL5244617

Cc1ccc(C(N)=O)c(C2CC2)c1-n1ccc2ccc(OCCN(C)C)cc2c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CHEK1 O14757 1/20 0.35
▸ RPS6KB1 P23443 2/20 0.35
▸ DYRK3 O43781 1/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ CSNK2A1 P68400 1/20 0.35
▸ PKN2 Q16513 1/20 0.35
▸ PIM3 Q86V86 1/20 0.35
▸ BRSK1 Q8TDC3 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35
▸ HIPK2 Q9H2X6 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35
▸ STK17A Q9UEE5 1/20 0.35
▸ MAP4K5 Q9Y4K4 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ TNKS O95271 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
SCHEMBL5279706 0.80 PARP1 (0.40) PKN2MKNK2PARP1
SCHEMBL1399865 0.73 KDM4E (0.45) KDM4EALDH1A1HPGDMCHR1THRA
SCHEMBL1399838 0.73 MAPK14 (0.53) KCNH2
SCHEMBL1399845 0.70 MAPK14 (0.44) KDM4EALDH1A1HPGDTHRAMEN1
SCHEMBL30343857 0.69 KDM4E (0.52) KDM4EALDH1A1HPGDCHEK1RPS6KB1
SCHEMBL1399786 0.69 MAPK14 (0.52) —
SCHEMBL5274702 0.68 CHUK (0.44) KDM4EALDH1A1RPS6KB1MCHR1MEN1
SCHEMBL1399881 0.67 MAPK14 (0.48) KDM4EALDH1A1HPGDDYRK3MEN1
SCHEMBL1400011 0.66 MAPK14 (0.51) —
SCHEMBL1399863 0.66 MAPK14 (0.52) KCNH2

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
EP-1831174-A1 AMIDE DERIVATIVES AstraZeneca AB (SE) 2007-09-12 — — EP disclosed
WO-2006067444-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2006-06-29 — — WO disclosed
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