SCHEMBL5954319

SCHEMBL5954319

Cc1cn([C@]2(C)O[C@H](CO)[C@@H](O)[C@H]2O)c(=S)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
ALB P02768 1/20 0.36
POLB P06746 1/20 0.36
ADRA1A P35348 1/20 0.36
BLM P54132 1/20 0.36
PYGL P06737 2/20 0.35
PYGB P11216 1/20 0.35
PYGM P11217 1/20 0.35
CDK1 P06493 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL12658380 0.88 TK1 (0.43) TK1ALDH1A1LMNAALBPOLB
SCHEMBL1825757 0.88 TK1 (0.43) TK1ALDH1A1LMNAALBPOLB
SCHEMBL27900813 0.87 PYGB (0.34) PYGLPYGBPYGM
SCHEMBL27900812 0.85 PYGM (0.33) PYGLPYGBPYGM
SCHEMBL28973925 0.84 PYGB (0.33) PYGLPYGBPYGM
SCHEMBL25191053 0.82 TK1 (0.37) TK1ALDH1A1LMNAALBPOLB
SCHEMBL8804692 0.82 PYGB (0.32) PYGLPYGBPYGM
SCHEMBL4849542 0.82 KDM4E (0.33) POLBPYGLPYGBPYGM
SCHEMBL16669918 0.81 TK1 (0.34) TK1ALDH1A1LMNAALBPOLB
SCHEMBL513129 0.80 PYGL (0.31) PYGLPYGBPYGM

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-1611249-A4 OLIGORIBONUCLEOTIDES AND RIBONUCLEASES FOR CLEAVING RNA ISIS PHARMACEUTICALS INC (US) 2006-06-28 EP disclosed
EP-1611249-A1 OLIGORIBONUCLEOTIDES AND RIBONUCLEASES FOR CLEAVING RNA ISIS PHARMACEUTICALS, INC. (US) 2006-01-04 EP disclosed
WO-2004097049-A1 OLIGORIBONUCLEOTIDES AND RIBONUCLEASES FOR CLEAVING RNA ISIS PHARMACEUTICALS, INC. (US) 2004-11-11 WO disclosed