⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8777495 | 0.97 | — | — | |
| SCHEMBL15939489 | 0.74 | — | — | |
| SCHEMBL6878945 | 0.73 | — | — | |
| SCHEMBL128784 | 0.73 | — | — | |
| SCHEMBL27503950 | 0.72 | — | — | |
| SCHEMBL3149508 | 0.71 | ALDH1A1 (0.52) | — | |
| SCHEMBL6178790 | 0.71 | — | — | |
| SCHEMBL4845519 | 0.70 | TET2 (0.37) | — | |
| SCHEMBL4845531 | 0.70 | TET2 (0.37) | — | |
| SCHEMBL283370 | 0.69 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117637186-A | Method for screening and preparing active molecule group in tripterygium plants and application thereof | 重庆市中药研究院 | 2024-03-01 | — | — | CN | disclosed |
| CN-117338831-A | Low-toxicity tripterygium wilfordii extract and preparation method and application thereof | 重庆市中药研究院 | 2024-01-05 | — | — | CN | disclosed |
| CN-110101702-A | System and method for treating bad pharmacodynamics response caused by opioid | 普渡制药公司 | 2019-08-09 | — | — | CN | disclosed |
| CN-107428767-B | The method for preparing low ABUK oxymorphone hydrochloride | 庄信万丰股份有限公司 | 2019-06-18 | — | — | CN | disclosed |
| CN-107428767-A | The method for preparing low ABUK oxymorphones hydrochloride | 庄信万丰股份有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-104302280-A | Systems and methods for treating opioid-induced adverse pharmacodynamic responses | PURDUE PHARMA LP | 2015-01-21 | — | — | CN | disclosed |
| EP-0812267-A1 | INK-RECEPTIVE ABSORBENT COATING | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1997-12-17 | — | — | EP | disclosed |
| EP-0812268-A1 | INK-RECEPTIVE SHEET | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1997-12-17 | — | — | EP | disclosed |
| WO-1996026840-A1 | INK-RECEPTIVE ABSORBENT COATING | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-09-06 | — | — | WO | disclosed |
| WO-1996026841-A1 | INK-RECEPTIVE SHEET | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-09-06 | — | — | WO | disclosed |
| EP-0656072-A4 | BINDER COMPOSITION AND PROCESS FOR AGGLOMERATING PARTICULATE MATERIAL. | AKZO NOBEL NV (NL) | 1996-06-26 | — | — | EP | disclosed |
| EP-0656072-A1 | BINDER COMPOSITION AND PROCESS FOR AGGLOMERATING PARTICULATE MATERIAL | Akzo Nobel N.V. (NL) | 1995-06-07 | — | — | EP | disclosed |
| WO-1994003648-A1 | BINDER COMPOSITION AND PROCESS FOR AGGLOMERATING PARTICULATE MATERIAL | AKZO NOBEL N.V. (NL) | 1994-02-17 | — | — | WO | disclosed |
| US-4663236-A | PHOTOPOLYMERIZABLE | FELIX SCHOELLER JR. GMBH & CO., KG (DE) | 1987-05-05 | — | — | US | disclosed |