SCHEMBL5379271

SCHEMBL5379271

CN(C)OC(=O)N1CCN(Cc2ccnc(Nc3nc4ccc(N(C)c5ccccc5)nc4s3)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.48
TBK1 Q9UHD2 11/20 0.44
LCK P06239 2/20 0.41

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
SCHEMBL5312848 0.92 KDR (0.51) KDRTBK1LCK
SCHEMBL5339092 0.91 KDR (0.56) KDRTBK1LCK
SCHEMBL5312745 0.89 KDR (0.55) KDRTBK1LCK
SCHEMBL5314902 0.87 KDR (0.46) KDRTBK1LCK
SCHEMBL5339002 0.86 KDR (0.43) KDRTBK1
SCHEMBL5311462 0.84 TBK1 (0.53) TBK1
SCHEMBL5310327 0.84 KDR (0.53) KDRTBK1LCK
SCHEMBL5334772 0.83 KDR (0.55) KDRTBK1LCK
SCHEMBL5311426 0.83 KDR (0.52) KDRTBK1LCK
SCHEMBL5331505 0.83 KDR (0.55) KDRTBK1LCK

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