⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5463903 | 0.97 | OPRM1 (0.36) | — | |
| SCHEMBL21753834 | 0.83 | OPRM1 (0.46) | — | |
| SCHEMBL4862604 | 0.79 | — | — | |
| SCHEMBL2499986 | 0.79 | — | — | |
| SCHEMBL12391772 | 0.79 | — | — | |
| SCHEMBL7948129 | 0.79 | GRM4 (0.35) | — | |
| Ammonia Solution, Strong SCHEMBL10941635 | 0.77 | GRM4 (0.33) | — | |
| SCHEMBL8670869 | 0.76 | OPRM1 (0.39) | — | |
| SCHEMBL29240935 | 0.76 | OPRM1 (0.34) | — | |
| SCHEMBL23776915 | 0.74 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114644877-A | Self-cleaning type corrosion-resistant weather-resistant polyurea coating | 广东达尔新型材料有限公司 | 2022-06-21 | — | — | CN | claimed |
| CN-107513341-B | Quick-drying high-solid polyurea coating, preparation method and application thereof | 北京碧海舟腐蚀防护工业股份有限公司 | 2020-01-10 | — | — | CN | claimed |
| EP-4265625-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | Lg Chem, Ltd. (KR) | 2023-10-25 | — | — | EP | disclosed |
| CN-114644877-A | Self-cleaning type corrosion-resistant weather-resistant polyurea coating | 广东达尔新型材料有限公司 | 2022-06-21 | — | — | CN | disclosed |
| CN-112512792-A | Laminate and method for producing laminate | 东洋纺株式会社 | 2021-03-16 | — | — | CN | disclosed |
| CN-107513341-B | Quick-drying high-solid polyurea coating, preparation method and application thereof | 北京碧海舟腐蚀防护工业股份有限公司 | 2020-01-10 | — | — | CN | disclosed |
| EP-2768308-B1 | COMPOUNDS AND ANTI-TUMOR NQO1 SUBSTRATES | UNIV ILLINOIS (US) | 2018-04-18 | — | — | EP | disclosed |
| EP-1687275-A4 | PYRIDIN-4-YLAMINE COMPOUNDS USEFUL IN THE TREATMENT OF NEUROPATHIC PAIN | MERCK & CO INC (US) | 2009-01-14 | — | — | EP | disclosed |
| EP-1687275-A1 | PYRIDIN-4-YLAMINE COMPOUNDS USEFUL IN THE TREATMENT OF NEUROPATHIC PAIN | Merck & Co., Inc. (US) | 2006-08-09 | — | — | EP | disclosed |
| WO-2005051915-A1 | PYRIDIN-4-YLAMINE COMPOUNDS USEFUL IN THE TREATMENT OF NEUROPATHIC PAIN | MERCK & CO., INC. (US) | 2005-06-09 | — | — | WO | disclosed |