⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7559230 | 0.61 | — | — | |
| Phosphoric Acid Monomethyl Ester SCHEMBL19942 | 0.61 | — | — | |
| SCHEMBL12143913 | 0.61 | — | — | |
| SCHEMBL33207 | 0.61 | — | — | |
| SCHEMBL29578 | 0.59 | — | — | |
| Phosphoric Acid Monomethyl Ester SCHEMBL25407716 | 0.58 | — | — | |
| Phosphoric Acid Monomethyl Ester SCHEMBL11053564 | 0.58 | — | — | |
| SCHEMBL16221281 | 0.58 | — | — | |
| Phosphoric Acid Monomethyl Ester SCHEMBL22518847 | 0.58 | — | — | |
| Phosphoric Acid Monomethyl Ester SCHEMBL11334053 | 0.58 | FDPS (0.47) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1113020-B1 | Nucleosides and oligonucleotides containing boron clusters | UNIV EMORY (US) | 2009-10-28 | — | — | EP | disclosed |
| US-6583122-B2 | Use in boron neutron capture therapy (BNCT) and diagnostic purposes; treating cancer, viral infections such as HIV, hepatitis B virus | EMORY UNIVERSITY | 2003-06-24 | — | — | US | disclosed |
| US-20020160969-A1 | Nucleosides and oligonucleotides containing boron clusters | DEPARTMENT OF VETERANS AFFAIRS | 2002-10-31 | — | — | US | disclosed |
| EP-1113020-A2 | Nucleosides and oligonucleotides containing boron clusters | EMORY UNIVERSITY (US) | 2001-07-04 | — | — | EP | disclosed |
| US-6180766-B1 | OLIGONUCLEOTIDE WITH UNCHARGED INTERNUCLEOTIDE LINKAGE(S) OF 3',5'-O,O-((CARBORAN-1-YL-METHYL)PHOSPHONATE); MADE BY REACTING O-METHYL(O-CARBORAN-1-YL)METHYL PHOSPHONATE WITH PROTECTED NUCLEOSIDE; USE IN BORON NEUTRON CAPTURE THERAPY | DEPARTMENT OF VETERANS AFFAIRS | 2001-01-30 | — | — | US | disclosed |
| US-5872107-A | ANTICARCINOGENIC AGENTS CAPTURE THERAPY FOR TUMORS | EMORY UNIVERSITY (US) | 1999-02-16 | — | — | US | disclosed |
| US-5599796-A | USING BORON CLUSTER-CONTAINING NUCLEOSIDES OR OLIGONUCLEOTIDES; PARTICULARLY EFFECTIVE FOR BLADDER, PROSTATE AND KIDNEY | EMORY UNIVERSITY (US) | 1997-02-04 | — | — | US | disclosed |