SCHEMBL13615609

SCHEMBL13615609

CO[C@H]1C(n2cc(C)c(=O)[nH]c2=O)O[C@@](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)(C(C)C)[C@H]1O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.36
TK2 O00142 2/20 0.36
TOP2A P11388 3/20 0.34
NT5M Q9NPB1 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
ALB P02768 1/20 0.33
POLB P06746 1/20 0.33
ADRA1A P35348 1/20 0.33
BLM P54132 1/20 0.33
RNASE1 P07998 1/20 0.33

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
SCHEMBL13616330 0.87 DUT (0.36)
SCHEMBL13615532 0.79 ALDH1A1 (0.45) TK1TK2ALDH1A1LMNAALB
SCHEMBL15689751 0.77 TK1 (0.38) TK1TOP2ANT5MRNASE1
SCHEMBL13273995 0.77 TK1 (0.38) TK1TOP2ANT5MALDH1A1LMNA
SCHEMBL1716526 0.77 TK1 (0.38) TK1TOP2ANT5MRNASE1
SCHEMBL16478991 0.77 TK1 (0.38) TK1TOP2ANT5MALDH1A1LMNA
SCHEMBL13615887 0.76 P2RY6 (0.43) ALDH1A1POLB
SCHEMBL8069871 0.75 TYMP (0.37) TK1TK2NT5MALDH1A1LMNA
SCHEMBL7708172 0.75 TOP2A (0.41) TK1TK2TOP2AALDH1A1LMNA
SCHEMBL7708175 0.75 TOP2A (0.41) TK1TK2TOP2AALDH1A1LMNA

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
WO-2009143369-A2 METHOD OF PREPARING NUCLEOSIDES AND ANALOGS THEREOF WITHOUT USING CHROMATOGRAPHY ISIS PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed