SCHEMBL1445019

SCHEMBL1445019

Cc1cn([C@H]2CC(OF)[C@@H](COP(=O)(O)O)O2)c(=O)[nH]c1=O

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.74
POLB P06746 2/20 0.61
TYMS P04818 1/20 0.60
POLA1 P09884 1/20 0.57
POLD1 P28340 1/20 0.57

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
SCHEMBL21068055 0.91 TK1 (0.74) TK1POLBTYMSPOLA1POLD1
SCHEMBL7038209 0.91 TK1 (0.74) TK1POLBTYMSPOLA1POLD1
SCHEMBL288740 0.91 TK1 (0.74) TK1POLBTYMSPOLA1POLD1
SCHEMBL9600789 0.90 POLB (0.71) TK1POLBTYMSPOLA1POLD1
SCHEMBL26479960 0.89 TK1 (0.71) TK1POLBTYMSPOLA1POLD1
SCHEMBL17577466 0.89 TK1 (0.71) TK1POLBTYMSPOLA1POLD1
SCHEMBL2053943 0.88 TK1 (0.70) TK1POLBTYMSPOLA1POLD1
SCHEMBL30583236 0.87 TK1 (0.77) TK1POLBTYMSPOLA1POLD1
SCHEMBL4747720 0.87 TK1 (0.77) TK1POLBTYMSPOLA1POLD1
SCHEMBL15989038 0.87 TK1 (0.71) TK1POLBTYMSPOLA1POLD1

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-2011036505-A1 NEW 6-SUBSTITUTED PYRIMIDINE DERIVATIVES Sveučilište u Zagrebu (HR) 2011-03-31 WO disclosed