SCHEMBL1098191

SCHEMBL1098191

COc1ccc(C(OC[C@@]23CO[C@@H]([C@H](n4ccc(NC(=O)c5ccccc5)nc4=O)O2)[C@@H]3OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 2/20 0.33
P2RY14 Q15391 2/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
NT5E P21589 1/20 0.33
POLB P06746 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
SCHEMBL4402273 1.00 P2RY6 (0.33) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL6441180 0.94 P2RY6 (0.33) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL4074674 0.92 P2RY6 (0.33) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL1096446 0.91
SCHEMBL209143 0.91 P2RY6 (0.33) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL4074822 0.89 P2RY6 (0.31) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL14813328 0.89 P2RY6 (0.34) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL209202 0.89 P2RY6 (0.34) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL210108 0.89 P2RY6 (0.34) P2RY6P2RY14ABL1RIN1NT5E
SCHEMBL2195626 0.89 P2RY6 (0.34) P2RY6P2RY14ABL1RIN1NT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153365-B2 Oligonucleotide analogues EXIQON A/S (DK) 2012-04-10 US disclosed
US-8080644-B2 Oligonucleotide analogues EXIQON A/S (DK) 2011-12-20 US disclosed
US-8034909-B2 Oligonucleotide analogues EXIQON A/S (DK) 2011-10-11 US disclosed
US-20110245327-A1 Oligonucleotide Analogues EXIQON A/S (DK) 2011-10-06 US disclosed
EP-2341058-A2 Oligonucleotide Analogues Exiqon A/S (DK) 2011-07-06 EP disclosed
EP-2341057-A2 Oligonucleotide Analogues Exiqon A/S (DK) 2011-07-06 EP disclosed
US-7906639-B2 Oligonucleotides having a 2′-O,4′-C-ethylene nucleotide in the third position of the 3′-end SANKYO COMPANY, LIMITED (JP) 2011-03-15 US disclosed
EP-2253639-A1 Bi- and tri-cyclic nucleoside, nucleotide and oligonucleoide analogues Exiqon A/S (DK) 2010-11-24 EP disclosed
US-20100279895-A1 OLIGONUCLEOTIDE ANALOGUES EXIQON A/S (DK) 2010-11-04 US disclosed
US-20100267018-A1 OLIGONUCLEOTIDE ANALOGUES EXIQON A/S (DK) 2010-10-21 US disclosed
US-7572582-B2 Oligonucleotide analogues EXIQON A/S (DK) 2009-08-11 US disclosed
EP-1688493-B1 METHOD OF DETECTING GENETIC POLYMORPHISM DAIICHI SANKYO CO LTD (JP) 2008-08-13 EP disclosed
US-20070009897-A1 Method of detecting genetic polymorphism SANKYO COMPANY, LIMITED (JP) 2007-01-11 US disclosed
EP-1688493-A1 METHOD OF DETECTING GENETIC POLYMORPHISM Sankyo Company, Limited (JP) 2006-08-09 EP disclosed
US-7034133-B2 Locked Nucleoside Analogues is a biochemical conjugate of nucleotides; as an aptamer in specific binding of antibiotics, drugs, amino acids, peptides, enzymes, saccharides, polysaccharides; heat resistance EXIQON A/S (DK) 2006-04-25 US disclosed
US-20050287566-A1 BICYCLIC LOCKED NUCLEOSIDE ANALOGUES; using an oligomer to isolate, purify, amplify, detect, identify, quantify or capture a natural or synthetic nucleic acid QIAGEN GMBH (DE) 2005-12-29 US disclosed
EP-1557424-A1 Bi-cyclic nucleoside, nucleotide and oligonucleoide analogues Exiqon A/S (DK) 2005-07-27 EP disclosed
US-6794499-B2 BICYCLIC LOCKED NUCLEOSIDE ANALOGUES EXIQON A/S (DK) 2004-09-21 US disclosed
US-6670461-B1 Bi-, tri, or polycyclic nucleoside analogues having a \"locked\" structure capable of forming heat resistant nucleobase specific duplexes and triplexes with single and double stranded nucleic acids. EXIQON A/S (DK) 2003-12-30 US disclosed
US-20030134808-A1 Oligonucleotide analogues WENGEL JESPER (DK) 2003-07-17 US 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 (6 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-20070009897-A1 Method of detecting genetic polymorphism DCLRE1B, ENY2, ENPP3 P2RY6 1810/4885P2RY14 1540/4885ABL1 3353/4885
US-20030134808-A1 Oligonucleotide analogues TARBP1, DCLRE1B, ADAR P2RY6 2779/4885P2RY14 1842/4885ABL1 4643/4885
US-20100267018-A1 OLIGONUCLEOTIDE ANALOGUES POLRMT, POLM, POLN P2RY6 1398/4885P2RY14 1731/4885ABL1 4189/4885
US-20110245327-A1 Oligonucleotide Analogues POLRMT, POLM, POLN P2RY6 1398/4885P2RY14 1731/4885ABL1 4189/4885
US-20050287566-A1 BICYCLIC LOCKED NUCLEOSIDE ANALOGUES; using an oligomer to isolate, purify, amplify, detect, identify, quantify or capture a natural or synthetic nucleic acid POLRMT, POLM, POLN P2RY6 1694/4885P2RY14 1103/4885ABL1 4584/4885
US-20100279895-A1 OLIGONUCLEOTIDE ANALOGUES POLRMT, POLM, POLN P2RY6 1398/4885P2RY14 1731/4885ABL1 4189/4885

“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.