SCHEMBL5205218

SCHEMBL5205218

CC(C)(C)[Si](C)(C)OC1CC(C(=O)O)(C(=O)O)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPM1D O15297 2/20 0.42
MAPK1 P28482 2/20 0.31
TP53 P04637 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 1/20 0.31
THPO P40225 1/20 0.31
STAT6 P42226 1/20 0.31
HIF1A Q16665 1/20 0.31
NPC1 O15118 1/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
MTOR P42345 1/20 0.31
RAB9A P51151 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL8537571 0.93 PPM1D (0.46) PPM1D
SCHEMBL12543318 0.84 PPM1D (0.44) PPM1DMAPK1TP53NFKB1CYP2C19
SCHEMBL30720748 0.82 PPM1D (0.41) PPM1DMAPK1TP53NFKB1CYP2C19
SCHEMBL8901744 0.81 PPM1D (0.38) PPM1D
SCHEMBL3178611 0.77 PPM1D (0.45) PPM1D
SCHEMBL8539978 0.77 PPM1D (0.45) PPM1D
SCHEMBL3622067 0.75 PPM1D (0.41) PPM1DMAPK1TP53NFKB1CYP2C19
SCHEMBL23704804 0.75 PPM1D (0.37) PPM1D
SCHEMBL3568839 0.74 PPM1D (0.37) PPM1D
SCHEMBL25497955 0.74 PPM1D (0.36) PPM1D

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-1603930-B1 PROTEIN-BOUND DERIVATIVES OF PLATINUM COMPLEXES CONTAINING CYCLOBUTANE 1.1-DICARBOXYLLATE LIGANDS KTB TUMORFORSCHUNGS GMBH (DE) 2007-08-29 EP claimed