SCHEMBL18809368

SCHEMBL18809368

CNC(=O)c1cc(Oc2ccc(NC(=O)NC3(C)CC4CC(C)CC(C4)C3)cc2)ccn1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 6/20 0.78
EPHX2 P34913 6/20 0.78
KDR P35968 7/20 0.52
MAPK14 Q16539 5/20 0.52
SRC P12931 3/20 0.52
HIPK4 Q8NE63 3/20 0.52
PLK4 O00444 2/20 0.52
AURKA O14965 2/20 0.52
MAPK13 O15264 2/20 0.52
MAP4K4 O95819 2/20 0.52
ABL1 P00519 2/20 0.52
LCK P06239 2/20 0.52
FYN P06241 2/20 0.52
LYN P07948 2/20 0.52
RET P07949 2/20 0.52
RPS6KB1 P23443 2/20 0.52
EPHA2 P29317 2/20 0.52
AXL P30530 2/20 0.52
FRK P42685 2/20 0.52
MAPK9 P45984 2/20 0.52

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
SCHEMBL12475017 0.88 EPHX2 (1.00) RAF1EPHX2KDRMAPK14SRC
SCHEMBL257980 0.80 RAF1 (0.82) RAF1EPHX2KDRMAPK14SRC
SCHEMBL1532339 0.77 RAF1 (0.77) RAF1EPHX2KDRMAPK14SRC
SCHEMBL10163311 0.76 RAF1 (0.76) RAF1EPHX2KDRMAPK14SRC
SCHEMBL12391532 0.76 RAF1 (0.76) RAF1EPHX2KDRMAPK14SRC
SCHEMBL19888730 0.75 RAF1 (0.78) RAF1EPHX2KDRMAPK14SRC
SCHEMBL28430251 0.75 RAF1 (0.78) RAF1EPHX2KDRMAPK14SRC
SCHEMBL16620832 0.75 RAF1 (0.74) RAF1EPHX2KDRMAPK14SRC
SCHEMBL3653979 0.74 RAF1 (0.69) RAF1EPHX2KDRMAPK14SRC
SCHEMBL13004737 0.74 RAF1 (0.69) RAF1EPHX2KDRMAPK14SRC

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
EP-2675274-B1 SORAFENIB DERIVATIVES AS sEH INHIBITORS UNIV CALIFORNIA (US) 2017-05-03 EP disclosed