SCHEMBL5740338

SCHEMBL5740338

CNC(=O)c1cc(Oc2ccc3c(C(=O)Nc4cc(C(F)(F)F)ccc4NC4CCN(C)C(C)C4)cccc3c2)ccn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.52
RET P07949 2/20 0.46
PLK4 O00444 1/20 0.46
AURKA O14965 1/20 0.46
MAPK13 O15264 1/20 0.46
JAK2 O60674 1/20 0.46
MAP4K4 O95819 1/20 0.46
ABL1 P00519 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
LYN P07948 1/20 0.46
ROS1 P08922 1/20 0.46
SRC P12931 1/20 0.46
RPS6KB1 P23443 1/20 0.46
EPHA2 P29317 1/20 0.46
TYK2 P29597 1/20 0.46
AXL P30530 1/20 0.46
FRK P42685 1/20 0.46
SYK P43405 1/20 0.46
MAPK9 P45984 1/20 0.46

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
SCHEMBL4548734 0.82 KDR (0.52) KDRRETPLK4AURKAMAPK13
SCHEMBL4548733 0.81 KDR (0.57) KDRRETPLK4AURKAMAPK13
SCHEMBL4548735 0.80 KDR (0.52) KDRRETPLK4AURKAMAPK13
SCHEMBL2747491 0.78 KDR (0.78) KDRRETPLK4AURKAMAPK13
SCHEMBL2437469 0.78 KDR (0.71) KDRRETPLK4AURKAMAPK13
SCHEMBL4548732 0.75 KDR (0.55) KDRRETPLK4AURKAMAPK13
SCHEMBL2748670 0.74 KDR (0.62) KDRRETPLK4AURKAMAPK13
SCHEMBL2747764 0.74 KDR (0.67) KDRAURKAABL1LCKLYN
SCHEMBL4548685 0.74 KDR (0.76) KDRRETPLK4AURKAMAPK13
SCHEMBL4548771 0.73 KDR (0.72) KDRAURKALCKAURKBFGFR1

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