SCHEMBL28072298

SCHEMBL28072298

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

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TK1 P04183 5/20 0.43
ALB P02768 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
ADRA1A P35348 1/20 0.41
BLM P54132 1/20 0.41
TYMP P19971 2/20 0.39
PYGM P11217 1/20 0.39
TK2 O00142 2/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL1825757 0.84 TK1 (0.43) TK1ALBALDH1A1LMNAPOLB
SCHEMBL12658380 0.84 TK1 (0.43) TK1ALBALDH1A1LMNAPOLB
SCHEMBL8904559 0.84 TK1 (0.43) TK1ALBALDH1A1LMNAPOLB
SCHEMBL16042097 0.82 TK1 (0.42) TK1ALBALDH1A1LMNAPOLB
SCHEMBL29041599 0.82 TK1 (0.42) TK1ALBALDH1A1LMNAPOLB
SCHEMBL27349255 0.82 TK1 (0.42) TK1ALBALDH1A1LMNAPOLB
SCHEMBL8053437 0.81 TK1 (0.42) TK1ALBALDH1A1LMNAPOLB
SCHEMBL3973110 0.81 PYGM (0.37) TK1LMNABLMPYGMTK2
SCHEMBL6753364 0.81 TK1 (0.41) TK1ALBALDH1A1LMNAPOLB
SCHEMBL28361568 0.81 TK1 (0.41) TK1ALBALDH1A1LMNAPOLB

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
CN-105566421-A Beta-thymidine preparation method JIANGSU DUCHENG PHARMACEUTICALS CO LTD 2016-05-11 CN disclosed