⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7523134 | 0.88 | — | — | |
| SCHEMBL20783 | 0.86 | — | — | |
| SCHEMBL16115125 | 0.86 | ALDH1A1 (0.32) | — | |
| Ammonia Solution, Strong SCHEMBL27781834 | 0.84 | — | — | |
| Fluoride SCHEMBL27691864 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL28132251 | 0.84 | — | — | |
| SCHEMBL27740131 | 0.84 | — | — | |
| Acetone SCHEMBL28370942 | 0.83 | LMNA (0.32) | — | |
| SCHEMBL11642540 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL27782885 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0617717-B1 | PHOSPHORUS-CONTAINING TRIAZINE COMPOUNDS AND THEIR USE | AKZO NOBEL UK LTD (GB) | 2002-03-13 | — | — | EP | disclosed |
| US-5534573-A | FLAME RETARDANTS | COURTAULDS PLC (GB) | 1996-07-09 | — | — | US | disclosed |
| EP-0617717-A1 | PHOSPHORUS-CONTAINING TRIAZINE COMPOUNDS AND THEIR USE | COURTAULDS PLC (GB) | 1994-10-05 | — | — | EP | disclosed |
| WO-1993012173-A2 | PHOSPHORUS-CONTAINING TRIAZINE COMPOUNDS AND THEIR USE | COURTAULDS PLC (GB) | 1993-06-24 | — | — | WO | disclosed |