⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL555067 | 0.92 | — | — | |
| Ethylene SCHEMBL29176429 | 0.85 | — | — | |
| Butane SCHEMBL9719741 | 0.83 | TSHR (0.32) | — | |
| Ethylene Glycol SCHEMBL9101387 | 0.76 | TSHR (0.31) | — | |
| Ethane SCHEMBL21591807 | 0.67 | TSHR (0.37) | — | |
| SCHEMBL28369351 | 0.67 | — | — | |
| SCHEMBL28124906 | 0.65 | — | — | |
| SCHEMBL2765 | 0.65 | — | — | |
| SCHEMBL2918378 | 0.62 | — | — | |
| SCHEMBL2919918 | 0.62 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11168231-B2 | Coating composition | COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) | 2021-11-09 | — | — | US | disclosed |
| US-20210230448-A1 | COATING COMPOSITION | COVESTRO DEUTSCHLAND AG (DE) | 2021-07-29 | — | — | US | disclosed |
| EP-3807335-A1 | COATING COMPOSITION | Covestro Intellectual Property GmbH & Co. KG (DE) | 2021-04-21 | — | — | EP | disclosed |
| EP-3783070-A1 | A WATERBORNE WHITE-BASE COATING | Covestro Deutschland AG (DE) | 2021-02-24 | — | — | EP | disclosed |
| EP-3599254-A1 | COATING COMPOSITION | Covestro Deutschland AG (DE) | 2020-01-29 | — | — | EP | disclosed |
| WO-2019238760-A1 | COATING COMPOSITION | COVESTRO DEUTSCHLAND AG (DE) | 2019-12-19 | — | — | WO | disclosed |