SCHEMBL3474850

SCHEMBL3474850

CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3cccc(C(N)=O)c3)cc2)no1.CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3ccnc(C(N)=O)c3)c2)no1.CNC(=O)c1cc(Oc2cccc(NC(=O)Nc3cc(C(C)(C)C)on3)c2)ccn1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 18/20 0.76
KDR P35968 2/20 0.76
MAPK13 O15264 2/20 0.56
MAPK14 Q16539 2/20 0.56
MAPK12 P53778 1/20 0.56
MAPK11 Q15759 1/20 0.56
RET P07949 2/20 0.56
PLK4 O00444 1/20 0.56
AURKA O14965 1/20 0.56
JAK2 O60674 1/20 0.56
MAP4K4 O95819 1/20 0.56
ABL1 P00519 1/20 0.56
LCK P06239 1/20 0.56
FYN P06241 1/20 0.56
LYN P07948 1/20 0.56
ROS1 P08922 1/20 0.56
SRC P12931 1/20 0.56
RPS6KB1 P23443 1/20 0.56
EPHA2 P29317 1/20 0.56
TYK2 P29597 1/20 0.56

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
SCHEMBL3475376 0.92 RAF1 (0.64) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL938160 0.88 RAF1 (0.66) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL13234850 0.87 RAF1 (1.00) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL939254 0.86 RAF1 (0.80) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL937729 0.85 RAF1 (0.83) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL14422915 0.81 RAF1 (0.68) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL13946067 0.81 RAF1 (0.82) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL668545 0.80 RAF1 (0.59) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL14422914 0.79 RAF1 (0.82) RAF1KDRMAPK13MAPK14MAPK12
SCHEMBL20434952 0.78 RAF1 (0.77) RAF1KDR

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-7838541-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE, LLC (US) 2010-11-23 US claimed