⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL486795 | 0.83 | TSHR (0.35) | — | |
| SCHEMBL7739147 | 0.81 | EED (0.35) | — | |
| SCHEMBL486923 | 0.81 | TSHR (0.34) | — | |
| SCHEMBL487018 | 0.75 | — | — | |
| SCHEMBL63961 | 0.70 | — | — | |
| SCHEMBL11306988 | 0.69 | CYP1A2 (0.31) | — | |
| SCHEMBL258437 | 0.69 | CYP1A2 (0.31) | — | |
| SCHEMBL5363307 | 0.67 | — | — | |
| SCHEMBL7620936 | 0.67 | — | — | |
| SCHEMBL6809678 | 0.63 | — | — |
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-0319480-B1 | Process for the methylation of triazine compounds containing 2,2,6,6-tetramethylpiperidine groups | CIBA GEIGY AG (CH) | 1994-01-26 | — | — | EP | disclosed |
| US-5130429-A | Methylation with formaldehyde in a solvent and distillation | CIBA-GEIGY CORPORATION (US) | 1992-07-14 | — | — | US | disclosed |
| EP-0319480-A2 | Process for the methylation of triazine compounds containing 2,2,6,6-tetramethylpiperidine groups | CIBA-GEIGY AG (CH) | 1989-06-07 | — | — | EP | disclosed |