⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL432447 | 0.69 | — | — | |
| Water SCHEMBL29070199 | 0.67 | FFAR3 (0.50) | — | |
| Ammonia Solution, Strong SCHEMBL28862368 | 0.67 | — | — | |
| SCHEMBL31058300 | 0.67 | — | — | |
| Methane SCHEMBL7078621 | 0.67 | — | — | |
| Ethane SCHEMBL359937 | 0.67 | — | — | |
| SCHEMBL481449 | 0.67 | — | — | |
| SCHEMBL3388976 | 0.67 | — | — | |
| SCHEMBL2539107 | 0.67 | — | — | |
| SCHEMBL4733814 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1474491-A1 | USE OF ANTI-ADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOOD | BASF AKTIENGESELLSCHAFT (DE) | 2004-11-10 | — | — | EP | claimed |
| WO-2003066763-A1 | USE OF ANTI-ADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOOD | BASF AKTIENGESELLSCHAFT (DE) | 2003-08-14 | — | — | WO | claimed |