SCHEMBL1058381

SCHEMBL1058381

CC(=O)O[C@H]1[C@H](n2cc(C)c(=O)[nH]c2=O)O[C@](CCOS(=O)(=O)c2ccc(C)cc2)(COCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.37
RNASE1 P07998 1/20 0.34
NT5M Q9NPB1 1/20 0.33
BCHE P06276 1/20 0.32
TK2 O00142 3/20 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
SCHEMBL1054675 0.91 TDP1 (0.34)
SCHEMBL16648575 0.87 TK1 (0.38) TK1RNASE1NT5MBCHETK2
SCHEMBL20394055 0.86 TK1 (0.37) TK1RNASE1NT5MBCHETK2
SCHEMBL28749276 0.86 TK1 (0.37) TK1RNASE1NT5MBCHETK2
SCHEMBL20394057 0.86 TK1 (0.37) TK1RNASE1NT5MBCHETK2
SCHEMBL23152969 0.85 TK2 (0.39) TK1RNASE1NT5MBCHETK2
SCHEMBL23152977 0.85 TK1 (0.41) TK1RNASE1NT5MBCHETK2
SCHEMBL23152967 0.85 TK1 (0.38) TK1RNASE1NT5MBCHETK2
SCHEMBL1097107 0.85 TK1 (0.37) TK1NT5MTK2
SCHEMBL1097256 0.84 TK1 (0.39) TK1RNASE1NT5MBCHETK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957201-B2 Oligonucleotide analogues and methods utilizing the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-17 US disclosed
US-20110009471-A1 Oligonucleotide analogues and methods utilizing the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-01-13 US disclosed
US-7816333-B2 Oligonucleotide analogues and methods utilizing the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-10-19 US disclosed
US-20090149404-A1 Oligonucleotide analogues and methods utilizing the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-06-11 US disclosed
US-7335765-B2 Nucleoside and oligonucleotide analogues DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-02-26 US disclosed
US-7314923-B2 Nucleoside and oligonucleotide analogues DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-01-01 US disclosed
US-20030207841-A1 Novel nucleoside and oligonucleotide analogues SANKYO COMPANY LIMITED (JP) 2003-11-06 US disclosed
US-20020147332-A1 Novel nucleoside and oligonucleotide analogues SANKYO COMPANY, LIMITED (JP) 2002-10-10 US disclosed
EP-1152009-A1 NOVEL NUCLEOSIDES AND OLIGONUCLEOTIDE ANALOGUES Sankyo Company, Limited (JP) 2001-11-07 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 (4 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-20110009471-A1 Oligonucleotide analogues and methods utilizing the same NSUN2, RNGTT, DUT TK1 52/4885RNASE1 17/4885NT5M 586/4885
US-20020147332-A1 Novel nucleoside and oligonucleotide analogues RNGTT, NSUN2, MTAP TK1 91/4885RNASE1 43/4885NT5M 542/4885
US-20090149404-A1 Oligonucleotide analogues and methods utilizing the same NSUN2, RNGTT, DUT TK1 52/4885RNASE1 17/4885NT5M 586/4885
US-20030207841-A1 Novel nucleoside and oligonucleotide analogues RNGTT, NSUN2, MTAP TK1 91/4885RNASE1 43/4885NT5M 542/4885

“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.