⚠ 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL3305833 | 0.97 | — | — | |
| SCHEMBL14827797 | 0.80 | — | — | |
| SCHEMBL27799578 | 0.78 | — | — | |
| SCHEMBL19721748 | 0.76 | — | — | |
| SCHEMBL25148675 | 0.76 | — | — | |
| SCHEMBL27552254 | 0.76 | PAOX (0.56) | — | |
| SCHEMBL4287778 | 0.72 | — | — | |
| SCHEMBL11804666 | 0.69 | — | — | |
| SCHEMBL26250052 | 0.69 | — | — | |
| SCHEMBL2333897 | 0.69 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240066135-A1 | DRUG CONJUGATES AND USES THEREOF | SUPERTRANS MEDICAL LTD (IL) | 2024-02-29 | — | — | US | disclosed |
| CN-104617338-B | Sodium rechargeable battery comprising forming slotted graphite felt | SK新技术株式会社 | 2019-11-12 | — | — | CN | disclosed |
| US-8110390-B2 | PRRS viruses, infectious clones, mutants thereof, and methods of use | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2012-02-07 | — | — | US | disclosed |
| WO-2005003099-A2 | PYRIMIDINES USEFUL AS MODULATORS OF VOLTAGE-GATED ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-01-13 | — | — | WO | disclosed |