⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2379897 | 0.66 | — | — | |
| SCHEMBL9403423 | 0.65 | — | — | |
| SCHEMBL449043 | 0.56 | — | — | |
| SCHEMBL525718 | 0.56 | — | — | |
| SCHEMBL11776487 | 0.56 | — | — | |
| Hydrochloric Acid SCHEMBL3693819 | 0.54 | — | — | |
| Hydrochloric Acid SCHEMBL9233653 | 0.54 | — | — | |
| SCHEMBL14718645 | 0.54 | — | — | |
| SCHEMBL3887277 | 0.54 | — | — | |
| SCHEMBL8098100 | 0.54 | — | — |
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-8993767-B2 | Multiphoton activable quinoline derivatives, their preparation and their uses | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2015-03-31 | — | — | US | disclosed |
| US-20130116281-A1 | Multiphoton Activable Quinoline Derivatives, Their Preparation and Their Uses | UNIVERSITÉ PARIS CITÉ (FR) | 2013-05-09 | — | — | US | disclosed |