SCHEMBL5753165

SCHEMBL5753165

COC(=O)c1cccc2cc(Nc3ncnc4cc(OC)c(OC)cc34)ccc12.COc1cc2ncnc(Nc3ccc4c(C(=O)O)cccc4c3)c2cc1OC

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 12/20 0.58
▸ EGFR P00533 8/20 0.57
▸ MAPK14 Q16539 1/20 0.57
▸ RET P07949 5/20 0.57
▸ KIF5B P33176 2/20 0.57
▸ FGFR1 P11362 1/20 0.57
▸ FLT1 P17948 1/20 0.57
▸ CDK2 P24941 1/20 0.57
▸ PIK3R1 P27986 1/20 0.57
▸ EPHB2 P29323 1/20 0.57
▸ TTBK1 Q5TCY1 1/20 0.57
▸ AURKA O14965 1/20 0.56
▸ AURKB Q96GD4 1/20 0.56
▸ CLK1 P49759 1/20 0.56
▸ ABCG2 Q9UNQ0 1/20 0.56
▸ NOD1 Q9Y239 1/20 0.56
▸ LCK P06239 2/20 0.55
▸ SRC P12931 1/20 0.55

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
SCHEMBL2746962 0.96 KDR (0.62) KDREGFRMAPK14RETKIF5B
SCHEMBL2746015 0.96 KDR (0.62) KDREGFRMAPK14RETKIF5B
SCHEMBL2747131 0.86 KDR (0.74) KDREGFRMAPK14RETAURKA
SCHEMBL2747187 0.82 KDR (0.71) KDREGFRMAPK14AURKAAURKB
SCHEMBL2747392 0.82 KDR (0.69) KDREGFRMAPK14RETKIF5B
SCHEMBL4549037 0.82 KDR (0.69) KDREGFRMAPK14RETKIF5B
SCHEMBL2747980 0.81 EGFR (0.68) KDREGFRMAPK14FLT1LCK
SCHEMBL2748014 0.80 KDR (0.75) KDREGFRFLT1AURKAAURKB
SCHEMBL7117747 0.79 KDR (0.71) KDREGFRRETKIF5BFGFR1
SCHEMBL6181200 0.78 EGFR (0.74) KDREGFRRETKIF5BFLT1

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
EP-1713484-A2 COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2006-10-25 — — EP disclosed
WO-2005070891-A2 COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2005-08-04 — — WO disclosed
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