SCHEMBL3842695

SCHEMBL3842695

COc1ccc(C(OC[C@@]23COCO[C@@H]([C@H](n4cc(C)c(=O)[nH]c4=O)O2)[C@@H]3OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TK2 O00142 10/20 0.33
TK1 P04183 4/20 0.32

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
SCHEMBL5557385 0.96 TK2 (0.34) TK2TK1
SCHEMBL2768845 0.96 TK2 (0.34) TK2TK1
SCHEMBL1099028 0.96 TK2 (0.34) TK2TK1
SCHEMBL7067321 0.96 TK2 (0.34) TK2TK1
SCHEMBL5861676 0.96 TK2 (0.34) TK2TK1
SCHEMBL26869 0.93 TK2 (0.33) TK2TK1
SCHEMBL3033795 0.87 TK2 (0.33) TK2TK1
SCHEMBL13383968 0.87 TK2 (0.32) TK2TK1
SCHEMBL1277763 0.87 TK2 (0.32) TK2TK1
SCHEMBL1408601 0.86

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2354148-B1 Nucleoside analogues and oligonucleotide derivative comprising nucleotide analogue thereof IMANISHI TAKESHI (JP) 2013-09-04 EP disclosed
US-7615619-B2 Nucleoside analogues and oligonucleotide derivative comprising nucleotide analogue thereof TAKESHI IMANISHI (JP) 2009-11-10 US disclosed
US-20060166908-A1 Nucloeside analogues and oligonucleotide derivative comprising nucleotide analogue thereof BNA INC. (JP) 2006-07-27 US disclosed
EP-1481983-A1 NUCLEOSIDE ANALOGUES AND OLIGONUCLEOTIDE DERIVATIVE COMPRISING NUCLEOTIDE ANALOGUE THEREOF Imanishi, Takeshi (JP) 2004-12-01 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060166908-A1 Nucloeside analogues and oligonucleotide derivative comprising nucleotide analogue thereof RNGTT, PNP, NT5C3B TK2 186/4885TK1 82/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.