SCHEMBL5315874

SCHEMBL5315874

Cc1ccc(N(C)c2ccc3nc(Nc4cc(CN5CCC(CC=O)CC5)ccn4)sc3n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.39
LCK P06239 2/20 0.37
TBK1 Q9UHD2 10/20 0.36
ACHE P22303 1/20 0.35
IKBKE Q14164 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
SCHEMBL5310867 0.89 LCK (0.41) KDRLCKTBK1IKBKE
SCHEMBL14530649 0.87 KDR (0.46) KDRLCKTBK1IKBKE
SCHEMBL5315868 0.87 LCK (0.42) KDRLCKTBK1
SCHEMBL5310872 0.86 KDR (0.40) KDRLCKTBK1IKBKE
SCHEMBL14530647 0.86 KDR (0.41) KDRLCKTBK1
SCHEMBL5312001 0.85 KDR (0.37) KDRLCKTBK1
SCHEMBL5335047 0.85 KDR (0.40) KDRLCKTBK1IKBKE
SCHEMBL14530996 0.84 KDR (0.39) KDRLCKTBK1IKBKE
SCHEMBL5379687 0.84 LCK (0.43) KDRLCKTBK1IKBKE
SCHEMBL5313989 0.84 KDR (0.44) KDRLCKTBK1IKBKE

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