⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20536873 | 1.00 | — | — | |
| SCHEMBL20536871 | 1.00 | — | — | |
| SCHEMBL22060610 | 0.91 | PTGER4 (0.36) | — | |
| SCHEMBL20536596 | 0.90 | MEN1 (0.32) | — | |
| SCHEMBL20218734 | 0.90 | MEN1 (0.32) | — | |
| SCHEMBL20536595 | 0.90 | MEN1 (0.32) | — | |
| SCHEMBL20536953 | 0.88 | — | — | |
| SCHEMBL20536955 | 0.88 | — | — | |
| SCHEMBL14732832 | 0.85 | — | — | |
| SCHEMBL14732827 | 0.83 | GBA1 (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-3483168-A1 | PROCESSES FOR PREPARING CYCLOPENTA[B]NAPHTHALENOL DERIVATIVES AND INTERMEDIATES THEREOF | Chirogate International Inc. (TW) | 2019-05-15 | — | — | EP | disclosed |