⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15807041 | 0.97 | — | — | |
| SCHEMBL15290271 | 0.82 | — | — | |
| SCHEMBL15807042 | 0.81 | — | — | |
| SCHEMBL15290267 | 0.81 | — | — | |
| SCHEMBL2600438 | 0.79 | PSMB5 (0.31) | — | |
| SCHEMBL15214825 | 0.78 | — | — | |
| SCHEMBL15290266 | 0.77 | — | — | |
| SCHEMBL15214821 | 0.74 | — | — | |
| SCHEMBL15214842 | 0.71 | — | — | |
| SCHEMBL15807040 | 0.71 | TSHR (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2651913-B1 | INDENO-FUSED RING COMPOUNDS HAVING PHOTOCHROMIC PROPERTIES | TRANSITIONS OPTICAL INC (US) | 2017-04-19 | — | — | EP | disclosed |