SCHEMBL5316017

SCHEMBL5316017

CONC(=O)c1cccc(NCc2ccc3nc(Nc4cc(CN5CCN(C(C)=O)CC5)ccn4)sc3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.51
LCK P06239 2/20 0.44
TBK1 Q9UHD2 7/20 0.40
FAAH O00519 1/20 0.38

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
SCHEMBL5314681 0.86 LCK (0.41) KDRLCK
SCHEMBL5314747 0.84 LCK (0.49) KDRLCK
SCHEMBL5315162 0.84 KDR (0.51) KDRLCKTBK1
SCHEMBL5314803 0.83 LCK (0.40) KDRLCK
SCHEMBL5313953 0.78 KDR (0.51) KDRLCK
SCHEMBL5312762 0.77 LCK (0.45) KDRLCKTBK1
SCHEMBL5310881 0.75 KDR (0.53) KDRLCKTBK1
SCHEMBL5311424 0.75 KDR (0.53) KDRLCKTBK1
SCHEMBL5315254 0.75 MAPT (0.42) KDRLCK
SCHEMBL5311465 0.75 KDR (0.46) KDRLCKTBK1

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