⚠ 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 | |
|---|---|---|---|---|
| Phosphoric Acid SCHEMBL27881838 | 0.89 | MMP2 (0.33) | — | |
| SCHEMBL4443922 | 0.85 | — | — | |
| SCHEMBL5685175 | 0.85 | — | — | |
| SCHEMBL5427524 | 0.81 | MEN1 (0.48) | — | |
| SCHEMBL3798056 | 0.81 | MEN1 (0.48) | — | |
| SCHEMBL27388515 | 0.81 | MEN1 (0.48) | — | |
| SCHEMBL308836 | 0.80 | — | — | |
| SCHEMBL28134441 | 0.80 | — | — | |
| SCHEMBL2058431 | 0.79 | — | — | |
| SCHEMBL3457032 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101715464-A | A process for the manufacture of natural oil hydroxylates | BIOBASED TECHNOLOGIES LLC | 2010-05-26 | — | — | CN | claimed |
| CN-101185034-A | Method for fine line resist stripping | ATOTECH DEUTSCHLAND GMBH (DE) | 2008-05-21 | — | — | CN | claimed |
| CN-101715464-A | A process for the manufacture of natural oil hydroxylates | BIOBASED TECHNOLOGIES LLC | 2010-05-26 | — | — | CN | disclosed |
| CN-101185034-A | Method for fine line resist stripping | ATOTECH DEUTSCHLAND GMBH (DE) | 2008-05-21 | — | — | CN | disclosed |