SCHEMBL5982297

SCHEMBL5982297

CC(C#N)(C#N)OP(=O)(O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.32
LMNA P02545 1/20 0.32
FDPS P14324 2/20 0.31
BLM P54132 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL26135756 0.76 FDPS (0.39) SMPD1FDPS
SCHEMBL9729488 0.70 SMPD1 (0.37) SMPD1
SCHEMBL3902815 0.70
SCHEMBL3202121 0.70 SMPD1 (0.37) SMPD1
SCHEMBL28729195 0.69 LMNA (0.40) SMPD1LMNAFDPSBLMTDP1
SCHEMBL27570533 0.69 LMNA (0.40) SMPD1LMNAFDPSBLMTDP1
SCHEMBL5963785 0.69 LMNA (0.40) SMPD1LMNAFDPSBLMTDP1
SCHEMBL332472 0.69
SCHEMBL5400918 0.67 LMNA (0.38) SMPD1LMNAFDPSBLMTDP1
Ammonia Solution, Strong SCHEMBL1310966 0.67 LMNA (0.38) SMPD1LMNAFDPSBLMTDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644394-A2 SYNTHESIS AND COMPOSITIONS OF 2 -TERMINATOR NUCLEOTIDES Roche Diagnostics GmbH (DE) 2006-04-12 EP disclosed
WO-2005026184-A9 SYNTHESIS AND COMPOSITIONS OF 2'-TERMINATOR NUCLEOTIDES ROCHE DIAGNOSTICS GMBH (DE) 2006-03-02 WO disclosed
WO-2005026184-A2 SYNTHESIS AND COMPOSITIONS OF 2'-TERMINATOR NUCLEOTIDES ROCHE DIAGNOSTICS GMBH (DE) 2005-03-24 WO disclosed