⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9231402 | 0.79 | CA12 (0.63) | — | |
| Norspermidine SCHEMBL15387 | 0.78 | — | — | |
| Norspermidine SCHEMBL22129782 | 0.78 | CA12 (0.92) | — | |
| SCHEMBL9893540 | 0.75 | — | — | |
| SCHEMBL870789 | 0.74 | CA12 (0.86) | — | |
| Norspermidine SCHEMBL1459588 | 0.74 | CA12 (0.86) | — | |
| SCHEMBL869672 | 0.74 | CA12 (0.86) | — | |
| SCHEMBL3062038 | 0.74 | CASP2 (1.00) | — | |
| Norspermidine SCHEMBL5031642 | 0.74 | CA12 (0.86) | — | |
| SCHEMBL869794 | 0.74 | CA12 (0.86) | — |
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-20230364246-A1 | METHODS FOR IMPROVED PROTECTION AND DELIVERY OF AMINOTHIOLS AND ANALOGS THEREOF | THE BURLINGTON HC RES GROUP INC (US) | 2023-11-16 | — | — | US | disclosed |
| US-20230364246-A1 | METHODS FOR IMPROVED PROTECTION AND DELIVERY OF AMINOTHIOLS AND ANALOGS THEREOF | THE BURLINGTON HC RES GROUP INC (US) | 2023-11-16 | — | — | US | disclosed |
| WO-2023028316-A1 | AMINOTHIOL-CONJUGATES, COMPOSITIONS, AND METHODS OF USE THEREOF | THE BURLINGTON HC RESEARCH GROUP, INC. (US) | 2023-03-02 | — | — | WO | disclosed |
| US-20210023229-A1 | METHODS FOR IMPROVED PROTECTION AND DELIVERY OF AMINOTHIOLS AND ANALOGS THEREOF | THE BURLINGTON HC RES GROUP INC (US) | 2021-01-28 | — | — | US | disclosed |