SCHEMBL15545978

SCHEMBL15545978

CNC(=O)c1cc(Oc2ccc([AsH2])cc2)ccn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.67
BRAF P15056 9/20 0.60
RAF1 P04049 7/20 0.60
EPHX2 P34913 3/20 0.60
PLK4 O00444 2/20 0.55
AURKA O14965 2/20 0.55
MAPK13 O15264 2/20 0.55
MAP4K4 O95819 2/20 0.55
ABL1 P00519 2/20 0.55
LCK P06239 2/20 0.55
FYN P06241 2/20 0.55
LYN P07948 2/20 0.55
RET P07949 2/20 0.55
SRC P12931 2/20 0.55
RPS6KB1 P23443 2/20 0.55
EPHA2 P29317 2/20 0.55
AXL P30530 2/20 0.55
FRK P42685 2/20 0.55
MAPK9 P45984 2/20 0.55
BLK P51451 2/20 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
SCHEMBL167964 0.87 KDR (0.68) KDRBRAFRAF1EPHX2PLK4
SCHEMBL5319531 0.86 KDR (0.67) KDRBRAFRAF1EPHX2PLK4
SCHEMBL26155567 0.86 KDR (0.67) KDRBRAFRAF1EPHX2PLK4
SCHEMBL177735 0.86 KDR (0.67) KDRBRAFRAF1EPHX2PLK4
SCHEMBL16651380 0.86 KDR (0.67) KDRBRAFRAF1EPHX2PLK4
SCHEMBL18681347 0.85 BRAF (0.70) KDRBRAFRAF1EPHX2PLK4
SCHEMBL13603818 0.84 KDR (0.65) KDRBRAFRAF1EPHX2PLK4
SCHEMBL3590776 0.84 BRAF (0.69) KDRBRAFRAF1EPHX2PLK4
SCHEMBL19149350 0.84 KDR (0.58) KDRBRAFRAF1EPHX2PLK4
SCHEMBL257980 0.83 RAF1 (0.82) KDRBRAFRAF1EPHX2PLK4

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-2922820-A1 PROCESS FOR PREPARING CRYSTALLINE SORAFENIB TOSYLATE Shilpa Medicare Limited (IN) 2015-09-30 EP disclosed
WO-2013175483-A1 PROCESS FOR PREPARING CRYSTALLINE SORAFENIB TOSYLATE SHILPA MEDICARE LIMITED (IN) 2013-11-28 WO disclosed