SCHEMBL6864855

SCHEMBL6864855

COc1cc2ncnc(Oc3ccc(NC(=O)NCCc4ccccn4)c(Cl)c3)c2cc1OC

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.76
FLT1 P17948 11/20 0.76
FLT4 P35916 11/20 0.76
KIT P10721 1/20 0.76
PDGFRA P16234 1/20 0.76

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
SCHEMBL5205783 0.92 KDR (0.73) KDRFLT1FLT4KITPDGFRA
SCHEMBL5205787 0.91 KDR (0.83) KDRFLT1FLT4KITPDGFRA
Krn-633 SCHEMBL29356072 0.86 KDR (1.00) KDRFLT1FLT4KITPDGFRA
Krn-633 SCHEMBL1249684 0.86 KDR (1.00) KDRFLT1FLT4KITPDGFRA
Krn-633 SCHEMBL29375090 0.86 KDR (1.00) KDRFLT1FLT4KITPDGFRA
SCHEMBL5207815 0.85 KDR (0.90) KDRFLT1FLT4KITPDGFRA
SCHEMBL5205625 0.84 KDR (0.86) KDRFLT1FLT4KITPDGFRA
SCHEMBL5202078 0.84 KDR (0.75) KDRFLT1FLT4KITPDGFRA
SCHEMBL5206267 0.84 KDR (0.88) KDRFLT1FLT4KITPDGFRA
SCHEMBL5205807 0.83 KDR (0.86) KDRFLT1FLT4KITPDGFRA

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
US-6797823-B1 Quinoline derivatives and quinazoline derivatives KIRIN BEER KABUSHIKI KAISHA (JP) 2004-09-28 US disclosed