⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL478074 | 0.66 | — | — | |
| SCHEMBL2802830 | 0.66 | — | — | |
| SCHEMBL477954 | 0.66 | — | — | |
| SCHEMBL332225 | 0.66 | — | — | |
| SCHEMBL7927573 | 0.64 | — | — | |
| SCHEMBL21598032 | 0.62 | — | — | |
| SCHEMBL7923861 | 0.61 | — | — | |
| SCHEMBL7648120 | 0.61 | — | — | |
| SCHEMBL7040085 | 0.61 | — | — | |
| SCHEMBL15403906 | 0.61 | — | — |
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-1015448-A4 | ANTI-CANCER DRUG ALDEHYDE CONJUGATE DRUGS WITH ENHANCED CYTOTOXICITY: COMPOUNDS, COMPOSITIONS AND METHODS | UNIV TECHNOLOGY CORP (US) | 2001-02-07 | — | — | EP | disclosed |
| EP-1015448-A1 | ANTI-CANCER DRUG ALDEHYDE CONJUGATE DRUGS WITH ENHANCED CYTOTOXICITY: COMPOUNDS, COMPOSITIONS AND METHODS | University Technology Corporation (US) | 2000-07-05 | — | — | EP | disclosed |
| WO-1998046598-A1 | ANTI-CANCER DRUG ALDEHYDE CONJUGATE DRUGS WITH ENHANCED CYTOTOXICITY: COMPOUNDS, COMPOSITIONS AND METHODS | UNIVERSITY TECHNOLOGY CORPORATION (US) | 1998-10-22 | — | — | WO | disclosed |