⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12320589 | 0.64 | — | — | |
| SCHEMBL9906151 | 0.52 | — | — | |
| Cyclopentane SCHEMBL10532996 | 0.41 | — | — | |
| Cyclopentane SCHEMBL1846422 | 0.41 | — | — | |
| Cyclooctane SCHEMBL31437963 | 0.41 | — | — | |
| Cyclohexane SCHEMBL333363 | 0.41 | — | — | |
| Cyclohexane SCHEMBL726989 | 0.41 | — | — | |
| Ethylene SCHEMBL9131469 | 0.41 | — | — | |
| Ethylene SCHEMBL20695617 | 0.41 | — | — | |
| Cyclohexane SCHEMBL5485545 | 0.41 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7902207-B2 | Process for production of amines | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2011-03-08 | — | — | US | disclosed |
| US-20070142639-A1 | Process for production of amines | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2007-06-21 | — | — | US | disclosed |