SCHEMBL7033423

SCHEMBL7033423

Cc1cn([C@@]2([C@@H]3OC[C@@H](O)[C@@H](O)[C@H]3O)C[C@H](O)[C@@H](CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.39
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
ALB P02768 1/20 0.36
PKM P14618 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL29474410 1.00 TK1 (0.39) TK1ALDH1A1NPSR1LMNATSHR
SCHEMBL7027956 1.00 TK1 (0.39) TK1ALDH1A1NPSR1LMNATSHR
SCHEMBL5698865 1.00 TK1 (0.39) TK1ALDH1A1NPSR1LMNATSHR
SCHEMBL29088052 0.98 TK1 (0.39) TK1ALDH1A1NPSR1LMNATSHR
SCHEMBL29763091 0.98 TK1 (0.39) TK1ALDH1A1NPSR1LMNATSHR
SCHEMBL9060459 0.89 TK1 (0.41) TK1ALDH1A1LMNAALBBLM
SCHEMBL5036896 0.89 TK1 (0.41) TK1ALDH1A1LMNAALBBLM
SCHEMBL7619980 0.82 TK2 (0.41) TK1ALBPKM
SCHEMBL5580099 0.82 TK1 (0.41) TK1ALDH1A1LMNATSHRALB
SCHEMBL29276434 0.81 TK1 (0.50) TK1

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-1019423-B1 METHOD FOR PRODUCING A PENTOPYRANOSYL NUCLEOSIDE NANOGEN RECOGNOMICS GMBH (DE) 2003-02-26 EP claimed