SCHEMBL5315162

SCHEMBL5315162

CONC(=O)c1cccc(N(C)c2ccc3nc(Nc4cc(CN5CCN(C(C)=O)CC5)ccn4)sc3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.51
LCK P06239 3/20 0.44
TBK1 Q9UHD2 9/20 0.40
BRAF P15056 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
SCHEMBL5312762 0.93 LCK (0.45) KDRLCKTBK1BRAF
SCHEMBL5310105 0.88 KDR (0.46) KDRLCKTBK1BRAF
SCHEMBL5311465 0.88 KDR (0.46) KDRLCKTBK1
SCHEMBL5314682 0.86 LCK (0.43) KDRLCKBRAF
SCHEMBL5314751 0.86 LCK (0.50) KDRLCKBRAF
SCHEMBL5314806 0.84 LCK (0.41) KDRLCKBRAF
SCHEMBL5310327 0.84 KDR (0.53) KDRLCKTBK1
SCHEMBL14530673 0.84 KDR (0.51) KDRLCKTBK1
SCHEMBL5316017 0.84 KDR (0.51) KDRLCKTBK1
SCHEMBL5311426 0.84 KDR (0.52) 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 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