⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL239774 | 0.86 | — | — | |
| SCHEMBL28268203 | 0.73 | — | — | |
| SCHEMBL2010694 | 0.65 | — | — | |
| SCHEMBL1012760 | 0.63 | CYP19A1 (0.32) | — | |
| SCHEMBL10613869 | 0.62 | — | — | |
| SCHEMBL146825 | 0.62 | — | — | |
| SCHEMBL2380263 | 0.60 | — | — | |
| SCHEMBL13570129 | 0.58 | — | — | |
| SCHEMBL10000973 | 0.58 | — | — | |
| SCHEMBL19337930 | 0.58 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1254882-B1 | PROCESS FOR PREPARING BICYCLO 2.2.1|HEPTANE DERIVATIVES | IDEMITSU KOSAN CO (JP) | 2006-05-24 | — | — | EP | disclosed |
| US-6841713-B2 | Process for preparing bicylo[2.2.1] heptane derivatives | IDEMITSU KOSAN CO., LTD. (JP) | 2005-01-11 | — | — | US | disclosed |
| US-20030045762-A1 | Process for preparing bicyclo[2.2.1] heptane derivatives | IDEMITSU KOSAN CO., LTD. (JP) | 2003-03-06 | — | — | US | disclosed |
| EP-1254882-A1 | PROCESS FOR PREPARING BICYCLO 2.2.1]HEPTANE DERIVATIVES | IDEMITSU KOSAN CO., LTD. (JP) | 2002-11-06 | — | — | EP | disclosed |