⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25223847 | 0.72 | — | — | |
| SCHEMBL6161513 | 0.71 | FNTA (0.35) | — | |
| SCHEMBL28858891 | 0.70 | LMNA (0.39) | — | |
| SCHEMBL7251635 | 0.70 | — | — | |
| SCHEMBL125682 | 0.69 | — | — | |
| SCHEMBL27694858 | 0.69 | — | — | |
| SCHEMBL27503826 | 0.67 | — | — | |
| SCHEMBL2408504 | 0.65 | — | — | |
| SCHEMBL3510994 | 0.65 | PTGS1 (0.46) | — | |
| SCHEMBL1310560 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5096781-A | Amine salts or quaternized compounds of 2,4-diphenyl-6-/2-/hydroxyphenyl/-s-triazine derivatives; color- and washfast inks for jet printing and recording | CIBA-GEIGY CORPORATION (US) | 1992-03-17 | — | — | US | disclosed |
| EP-0374751-A2 | Water-soluble light-projecting materials | CIBA-GEIGY AG (CH) | 1990-06-27 | — | — | EP | disclosed |