SCHEMBL2379938

SCHEMBL2379938

COOC[C@H]1O[C@](n2cc(C)c(=O)[nH]c2=O)(C(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@@H]1OC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.37
TK1 P04183 9/20 0.34
TK2 O00142 7/20 0.34
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NT5M Q9NPB1 1/20 0.33

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
SCHEMBL4384199 0.87 TK1 (0.38) TK1TK2
SCHEMBL4135171 0.87 TK1 (0.38) TK1TK2
SCHEMBL4592382 0.85 TK2 (0.36) TK1TK2
SCHEMBL4856132 0.78 HSP90AA1 (0.38) TK1
SCHEMBL1727535 0.77 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL8200498 0.76 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL8200495 0.76 RNASE1 (0.40) RNASE1TK1TK2
SCHEMBL8426742 0.76 TK1 (0.38) TK1TK2
SCHEMBL7743997 0.75 TK1 (0.37) TK1TK2
SCHEMBL8370048 0.75 RNASE1 (0.38) RNASE1TK1TK2

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
US-8026348-B2 Nucleoside derivative, modified oligonucleotide, method for their synthesis and applications thereof LESNIKOWSKI ZBIGNIEW J 2011-09-27 US disclosed