SCHEMBL22700152

SCHEMBL22700152

CC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)C[C@@H]1O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 8/20 0.49
HDAC1 Q13547 1/20 0.36
THRB P10828 1/20 0.34
ALOX15 P16050 1/20 0.34
FKBP1A P62942 1/20 0.34
DUT P33316 1/20 0.32
PRKCA P17252 5/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL16778074 0.80 TOP2A (0.48) TOP2AHDAC1DUTPRKCA
SCHEMBL4392005 0.80 TOP2A (0.48) TOP2AHDAC1DUTPRKCA
SCHEMBL19464421 0.80 TOP2A (0.48) TOP2AHDAC1DUTPRKCA
SCHEMBL20019772 0.80 TOP2A (0.46) TOP2AHDAC1FKBP1APRKCA
SCHEMBL20211424 0.78 TOP2A (0.45) TOP2AHDAC1FKBP1ADUTSMN1; SMN2
SCHEMBL9264253 0.77 TOP2A (0.43) TOP2A
SCHEMBL6334886 0.77 TOP2A (0.46) TOP2AHDAC1DUT
SCHEMBL21343867 0.77 TOP2A (0.46) TOP2AHDAC1PRKCA
SCHEMBL6406006 0.77 TOP2A (0.46) TOP2AHDAC1DUT
SCHEMBL8412572 0.75 TOP2A (0.37) TOP2AFKBP1ASMN1; SMN2

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-3512860-B1 NUCLEOSIDE AND NUCLEOTIDE ANALOGUES BEARING A QUATERNARY ALL-CARBON STEREOGENIC CENTER AT THE 2' POSITION AND METHODS OF USE AS A CARDIOPROTECTIVE AGENT LCB PHARMA INC (CA) 2020-11-25 EP disclosed