⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9334056 | 0.75 | — | — | |
| SCHEMBL3583741 | 0.74 | — | — | |
| SCHEMBL662994 | 0.74 | — | — | |
| SCHEMBL3425766 | 0.72 | KDM4E (0.30) | — | |
| SCHEMBL517125 | 0.72 | TSHR (0.30) | — | |
| SCHEMBL8423128 | 0.72 | TSHR (0.30) | — | |
| SCHEMBL5439184 | 0.67 | — | — | |
| SCHEMBL5473399 | 0.67 | — | — | |
| SCHEMBL3571508 | 0.67 | — | — | |
| SCHEMBL7530651 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20040029908-A1 | Tricyclo compounds, a process for their production and a pharmaceutical composition containing the same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-02-12 | — | — | US | disclosed |
| CN-1100538-C | Lotion formulation | FUJISAWA PHARMACEUTICAL CO (JP) | 2003-02-05 | — | — | CN | disclosed |
| CN-1124925-A | Lotion | FUJISAWA PHARMACEUTICAL CO (JP) | 1996-06-19 | — | — | CN | disclosed |
| CN-1093571-A | Parmaceutical agent | FUJISAWA PHARMACEUTICAL CO (JP) | 1994-10-19 | — | — | CN | disclosed |