⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5864194 | 0.80 | — | — | |
| SCHEMBL28850996 | 0.80 | HTR2C (0.33) | — | |
| SCHEMBL5864408 | 0.77 | — | — | |
| SCHEMBL14690060 | 0.76 | — | — | |
| SCHEMBL5384628 | 0.74 | — | — | |
| SCHEMBL17340376 | 0.74 | — | — | |
| SCHEMBL1715471 | 0.74 | — | — | |
| SCHEMBL6911657 | 0.73 | — | — | |
| SCHEMBL1715738 | 0.73 | — | — | |
| SCHEMBL6903874 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1066337-B1 | OXYGEN SCAVENGERS WITH REDUCED OXIDATION PRODUCTS FOR USE IN PLASTIC FILMS AND BEVERAGE AND FOOD CONTAINERS | CHEVRON PHILLIPS CHEMICAL CO (US) | 2004-11-03 | — | — | EP | claimed |
| US-8748570-B2 | Insulin analogues | SYNGENE LIMITED (AU) | 2014-06-10 | — | — | US | disclosed |
| US-20120225811-A1 | INSULIN ANALOGUES | POLYCHIP PHARMACEUTICALS PTY LTD (AU) | 2012-09-06 | — | — | US | disclosed |
| US-4835239-A | Diisocyanates and their use for the preparation of polyurethanes | BAYER AKTIENGESELLSCHAFT (DE) | 1989-05-30 | — | — | US | disclosed |
| US-4613685-A | Aliphatic-cycloaliphatic diisocyanates | BAYER AKTIENGESELLSCHAFT (DE) | 1986-09-23 | — | — | US | disclosed |