⚠ 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 | |
|---|---|---|---|---|
| Ethylenediamine SCHEMBL4788802 | 0.69 | ODC1 (0.32) | — | |
| SCHEMBL31469075 | 0.69 | — | — | |
| SCHEMBL8778613 | 0.67 | — | — | |
| SCHEMBL7921744 | 0.67 | — | — | |
| SCHEMBL4563364 | 0.67 | — | — | |
| SCHEMBL6887412 | 0.61 | — | — | |
| SCHEMBL4024620 | 0.61 | — | — | |
| Ethylene SCHEMBL248596 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL9677065 | 0.59 | — | — | |
| SCHEMBL3629399 | 0.59 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0641354-A4 | OLIGONUCLEOTIDES HAVING AMINOHYDROCARBON PHOSPHONATE MOIETIES. | PHARMAGENICS INC (US) | 1996-01-10 | — | — | EP | disclosed |
| EP-0641354-A1 | OLIGONUCLEOTIDES HAVING AMINOHYDROCARBON PHOSPHONATE MOIETIES | PHARMAGENICS, INC. (US) | 1995-03-08 | — | — | EP | disclosed |
| WO-1993011148-A1 | OLIGONUCLEOTIDES HAVING AMINOHYDROCARBON PHOSPHONATE MOIETIES | PHARMAGENICS, INC. (US) | 1993-06-10 | — | — | WO | disclosed |