SCHEMBL6248487

SCHEMBL6248487

CC(C)(C)c1ccc([Si](C)(C)C)c(NC(=O)Nc2ccc(N3CCC(CN4CCOCC4)CC3)c3ccccc23)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.49
BRAF P15056 3/20 0.44
ABL1 P00519 2/20 0.42
EGFR P00533 2/20 0.42
RAF1 P04049 2/20 0.42
LYN P07948 2/20 0.42
EPHA2 P29317 2/20 0.42
EPHA3 P29320 2/20 0.42
MAPK9 P45984 2/20 0.42
AKT1 P31749 1/20 0.42
MAPK13 O15264 3/20 0.41
MAPK12 P53778 3/20 0.41
MAPK11 Q15759 3/20 0.41
TNF P01375 5/20 0.41
CIT O14578 1/20 0.40
MUSK O15146 1/20 0.40
MAP3K7 O43318 1/20 0.40
RIPK2 O43353 1/20 0.40
STK10 O94804 1/20 0.40
MAP4K4 O95819 1/20 0.40

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
SCHEMBL4082137 0.91 THRB (0.50) MAPK14BRAFABL1EGFRRAF1
SCHEMBL4092545 0.89 MAPK14 (0.61) MAPK14BRAFABL1EGFRRAF1
SCHEMBL6249247 0.86 MAPK14 (0.49) MAPK14BRAFABL1EGFRRAF1
SCHEMBL4095891 0.86 MAPK14 (0.51) MAPK14BRAFABL1EGFRRAF1
SCHEMBL5388339 0.80 MAPK14 (0.53) MAPK14BRAFRAF1MAPK13MAPK12
SCHEMBL5384351 0.79 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL4092120 0.78 MAPK14 (0.71) MAPK14BRAFABL1EGFRRAF1
SCHEMBL6913451 0.77 MAPK14 (0.51) MAPK14BRAFABL1EGFRRAF1
SCHEMBL5619010 0.75 MAPK14 (0.67) MAPK14BRAFABL1EGFRRAF1
SCHEMBL6249256 0.75 MAPT (0.48) MAPK14MAPK13MAPK12MAPK11THRB

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
WO-2005044825-A1 SILICON COMPOUNDS AND THEIR USE AMEDIS PHARMACEUTICALS LTD. (GB) 2005-05-19 WO claimed
WO-2005044825-A1 SILICON COMPOUNDS AND THEIR USE AMEDIS PHARMACEUTICALS LTD. (GB) 2005-05-19 WO disclosed