SCHEMBL1408780

SCHEMBL1408780

CC(=O)O[C@H]1[C@H](n2cc(C)c(=O)[nH]c2=O)O[C@@](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)(COS(=O)(=O)c2ccc(C)cc2)[C@H]1OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.33
BCHE P06276 2/20 0.32
RNASE1 P07998 1/20 0.32
NT5M Q9NPB1 1/20 0.31
ELANE P08246 1/20 0.31
TOP2A P11388 1/20 0.30

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
SCHEMBL1716871 0.90 TK1 (0.37) TK1BCHETOP2A
SCHEMBL13722465 0.84 TDP1 (0.32)
SCHEMBL16661547 0.83 TK1 (0.35) TK1BCHERNASE1NT5MTOP2A
SCHEMBL19261579 0.83 TK1 (0.35) TK1BCHERNASE1NT5MTOP2A
SCHEMBL16772712 0.83 TK1 (0.35) TK1BCHERNASE1NT5MTOP2A
SCHEMBL16648780 0.83 TK1 (0.35) TK1BCHERNASE1NT5MTOP2A
SCHEMBL1058381 0.83 TK1 (0.37) TK1BCHERNASE1NT5M
SCHEMBL28618584 0.83 TK1 (0.39) TK1BCHERNASE1NT5M
SCHEMBL28618582 0.83 TK1 (0.39) TK1BCHERNASE1NT5M
SCHEMBL5696121 0.83 TK1 (0.39) TK1BCHERNASE1NT5M

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1013661-B2 2'-O,4'-C-methylene bicyclonucleosides EXIQON AS (DK) 2018-10-24 EP disclosed
EP-2361921-B1 Bicyclo-oligonucleotide analogues EXIQON AS (DK) 2015-06-03 EP disclosed
EP-2295441-B1 Bicyclonucleoside Oligonucleotide Analogue EXIQON AS (DK) 2014-05-07 EP disclosed
US-RE44779-E1 Bicyclonucleoside and oligonucleotide analogues SANTARIS PHARMA A/S (DK) 2014-02-25 US disclosed
EP-1013661-B1 2'-O,4'-C-methylene bicyclonucleosides EXIQON AS (DK) 2012-01-18 EP disclosed
EP-2361921-A2 Novel bicyclonucleoside and oligonnucleotide analogue Exiqon A/S (DK) 2011-08-31 EP disclosed
EP-2295441-A2 Novel Bicyclonucleoside and Oligonucleotide Analogue Exiqon A/S (DK) 2011-03-16 EP disclosed
US-6770748-B2 ANTISENSE AGENTS FOR AIDS; IMMOBILIZED CONFORMATION OF THE SUGAR PORTION OF NUCLEIC ACID Imanishi, Takeshi (JP) 2004-08-03 US disclosed
US-20030105309-A1 Novel bicyclonucleoside and oligonucleotide analogue TAKESHI IMANISHI (JP) 2003-06-05 US disclosed
US-6268490-B1 NUCLEOSIDE ANALOG; FOR ANTISENSE AGENT WHICH IS HYDROLASE RESISTANT, HAS HIGH SENSE STRAND BINDING ABILITY AND IS EASILY SYNTHESIZED TAKESHI IMANISHI (JP) 2001-07-31 US disclosed
EP-1013661-A1 NOVEL BICYCLONUCLEOSIDE AND OLIGONUCLEOTIDE ANALOGUES Imanishi, Takeshi (JP) 2000-06-28 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-20030105309-A1 Novel bicyclonucleoside and oligonucleotide analogue DCLRE1B, POLA1, POLB TK1 16/4885BCHE 933/4885RNASE1 6/4885

“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.