⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4830192 | 0.67 | — | — | |
| SCHEMBL14662005 | 0.67 | — | — | |
| SCHEMBL20509043 | 0.67 | — | — | |
| SCHEMBL27408179 | 0.67 | — | — | |
| SCHEMBL6914404 | 0.63 | — | — | |
| SCHEMBL23080159 | 0.62 | — | — | |
| SCHEMBL13717449 | 0.61 | — | — | |
| SCHEMBL31003573 | 0.61 | ALDH1A1 (0.36) | — | |
| SCHEMBL27610897 | 0.61 | — | — | |
| SCHEMBL27326342 | 0.60 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10023462-B2 | Niobium-Nitride film forming compositions and vapor deposition of Niobium-Nitride films | L'Air Liquide, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) | 2018-07-17 | — | — | US | disclosed |