⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8400552 | 1.00 | — | — | |
| SCHEMBL9447578 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL7606935 | 0.95 | — | — | |
| SCHEMBL1082522 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL29770543 | 0.89 | LMNA (0.30) | — | |
| SCHEMBL11670752 | 0.89 | — | — | |
| Fluoride SCHEMBL29453582 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL3057796 | 0.89 | — | — | |
| SCHEMBL9146834 | 0.89 | — | — | |
| SCHEMBL10339664 | 0.89 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107446169-B | Elastic calcium alginate/line borate hybrid inorganic-organic materials and preparation method thereof | 青岛大学 | 2019-04-23 | — | — | CN | disclosed |
| CN-101965385-A | Chromate-free corrosion protection for fuel tanks | MANKIEWICZ GEBR & CO | 2011-02-02 | — | — | CN | disclosed |
| US-6071459-A | Process of making metathesis polymerized olefin articles containing flame-retarding agents | A. O. SMITH CORPORATION (US) | 2000-06-06 | — | — | US | disclosed |