⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL812726 | 1.00 | — | — | |
| SCHEMBL3674673 | 0.98 | — | — | |
| SCHEMBL3674675 | 0.98 | — | — | |
| SCHEMBL17027683 | 0.85 | ALDH1A1 (0.36) | — | |
| SCHEMBL17027685 | 0.85 | ALDH1A1 (0.36) | — | |
| SCHEMBL17027684 | 0.85 | ALDH1A1 (0.36) | — | |
| Cyclohexene SCHEMBL7601558 | 0.79 | — | — | |
| SCHEMBL14435387 | 0.77 | — | — | |
| SCHEMBL12977684 | 0.77 | — | — | |
| SCHEMBL14435389 | 0.77 | — | — |
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-2407444-A2 | Process for the preparation of dodecanedioic acid | Invista Technologies S.a r.l. (CH) | 2012-01-18 | — | — | EP | disclosed |
| EP-2257516-A2 | METHODS OF MAKING CYCLODODECATRIENE AND METHODS OF MAKING LAUROLACTONE | Invista Technologies S.à.r.l. (CH) | 2010-12-08 | — | — | EP | disclosed |
| WO-2009117498-A2 | METHODS OF MAKING CYCLODODECATRIENE AND METHODS OF MAKING LAUROLACTONE | INVISTA TECHNOLOGIES S.A R.L. (CH) | 2009-09-24 | — | — | WO | disclosed |
| US-20090240068-A1 | METHODS OF MAKING CYCLODODECATRIENE AND METHODS OF MAKING LAUROLACTONE | INVISTA NORTH AMERICA S.A.R.L. (US) | 2009-09-24 | — | — | US | disclosed |