SCHEMBL5331156

SCHEMBL5331156

CN(c1ccc2nc(Nc3cc(CN4CCOCC4)ccn3)sc2n1)c1ccc(Cl)cc1F

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.47
KDR P35968 9/20 0.45
EGFR P00533 1/20 0.39
CHEK1 O14757 1/20 0.38
SIK2 Q9H0K1 1/20 0.38
SIK3 Q9Y2K2 1/20 0.38
EPHB4 P54760 1/20 0.36
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
CLK1 P49759 1/20 0.35
KMT2A Q03164 1/20 0.35
TNIK Q9UKE5 1/20 0.35
APP P05067 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
SCHEMBL14530632 0.92 KDR (0.46) LCKKDREGFRCHEK1SIK2
SCHEMBL5313703 0.92 LCK (0.39) LCKKDR
SCHEMBL5314665 0.89 LCK (0.40) LCKKDR
SCHEMBL14531020 0.88 LCK (0.49) LCKKDREGFRCHEK1SIK2
SCHEMBL14530838 0.85 KDR (0.48) LCKKDRCHEK1SIK2SIK3
SCHEMBL14531379 0.84 KDR (0.39) LCKKDR
SCHEMBL5315530 0.81 KDR (0.39) LCKKDR
SCHEMBL5335400 0.81 KDR (0.53) LCKKDR
SCHEMBL5339002 0.78 KDR (0.43) KDR
SCHEMBL5379687 0.77 LCK (0.43) LCKKDR

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
WO-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO disclosed
WO-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO disclosed