⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL114386 | 0.81 | — | — | |
| SCHEMBL8987498 | 0.76 | CA1 (0.44) | — | |
| SCHEMBL6664616 | 0.74 | — | — | |
| SCHEMBL30892642 | 0.74 | TSHR (0.50) | — | |
| SCHEMBL15066125 | 0.73 | TRIM24 (0.44) | — | |
| SCHEMBL9051493 | 0.71 | TSHR (0.47) | — | |
| SCHEMBL27928489 | 0.71 | TSHR (0.47) | — | |
| SCHEMBL15776453 | 0.71 | TSHR (0.47) | — | |
| SCHEMBL27910776 | 0.71 | TSHR (0.47) | — | |
| SCHEMBL541094 | 0.69 | CA1 (0.41) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109313388-B | Negative photosensitive composition | 住友电木株式会社 | 2022-06-21 | — | — | CN | claimed |
| WO-2006070381-A1 | AMINO-FUNCTIONALIZED 1,2,4-TRIOXANES USEFUL AS ANTI-MALARIAL AGENTS AND PROCESS FOR PREPARATION THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-07-06 | — | — | WO | claimed |
| US-7071226-B1 | Amino-functionalized 1,2,4-trioxanes useful as antimalarial agents and process for preparation thereof | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-07-04 | — | — | US | claimed |
| US-20060142378-A1 | AMINO-FUNCTIONALIZED 1,2,4-TRIOXANES USEFUL AS ANTIMALARIAL AGENTS AND PROCESS FOR PREPARATION THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-06-29 | — | — | US | claimed |
| CN-109313388-B | Negative photosensitive composition | 住友电木株式会社 | 2022-06-21 | — | — | CN | disclosed |
| US-7495025-B2 | Spiro-1,2,4-trioxanes | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2009-02-24 | — | — | US | disclosed |
| WO-2006070381-A1 | AMINO-FUNCTIONALIZED 1,2,4-TRIOXANES USEFUL AS ANTI-MALARIAL AGENTS AND PROCESS FOR PREPARATION THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-07-06 | — | — | WO | disclosed |
| US-7071226-B1 | Amino-functionalized 1,2,4-trioxanes useful as antimalarial agents and process for preparation thereof | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-07-04 | — | — | US | disclosed |
| US-20060142378-A1 | AMINO-FUNCTIONALIZED 1,2,4-TRIOXANES USEFUL AS ANTIMALARIAL AGENTS AND PROCESS FOR PREPARATION THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-06-29 | — | — | US | disclosed |