⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11675422 | 0.97 | GAA (0.31) | — | |
| SCHEMBL10961446 | 0.97 | GAA (0.31) | — | |
| SCHEMBL190432 | 0.86 | ALDH1A1 (0.36) | — | |
| SCHEMBL3151426 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL18426094 | 0.82 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL699521 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL9634079 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL301767 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL22157999 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL4263773 | 0.82 | ALDH1A1 (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117384210-A | Zero-valent nickel coordination compound, preparation method and application thereof | 苏州深云慧材智能科技研发有限公司 | 2024-01-12 | — | — | CN | claimed |
| CN-108136382-B | Novel catalytic composition comprising nickel and a phosphine-type ligand complexed with nickel and use thereof in a process for oligomerizing olefins | IFP 新能源公司 | 2021-06-15 | — | — | CN | claimed |
| US-10300473-B2 | Catalytic composition comprising nickel and a ligand of the phosphane complexed with nickel type, and use thereof in a olefin oligomerisation method | IFP Energies Nouvelles (FR) | 2019-05-28 | — | — | US | claimed |
| US-20180221861-A1 | NOVEL CATALYTIC COMPOSITION COMPRISING NICKEL AND A LIGAND OF THE PHOSPHANE COMPLEXED WITH NICKEL TYPE, AND USE THEREOF IN A OLEFIN OLIGOMERISATION METHOD | IFP Energies Nouvelles (FR) | 2018-08-09 | — | — | US | claimed |
| CN-117384210-A | Zero-valent nickel coordination compound, preparation method and application thereof | 苏州深云慧材智能科技研发有限公司 | 2024-01-12 | — | — | CN | disclosed |
| US-10300473-B2 | Catalytic composition comprising nickel and a ligand of the phosphane complexed with nickel type, and use thereof in a olefin oligomerisation method | IFP Energies Nouvelles (FR) | 2019-05-28 | — | — | US | disclosed |
| US-20180221861-A1 | NOVEL CATALYTIC COMPOSITION COMPRISING NICKEL AND A LIGAND OF THE PHOSPHANE COMPLEXED WITH NICKEL TYPE, AND USE THEREOF IN A OLEFIN OLIGOMERISATION METHOD | IFP Energies Nouvelles (FR) | 2018-08-09 | — | — | US | disclosed |