⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9664573 | 0.86 | — | — | |
| SCHEMBL3044885 | 0.82 | — | — | |
| SCHEMBL3253791 | 0.79 | MEN1 (0.35) | — | |
| SCHEMBL254649 | 0.77 | GNAO1 (0.38) | — | |
| SCHEMBL3537893 | 0.76 | — | — | |
| SCHEMBL6921851 | 0.76 | — | — | |
| SCHEMBL3254587 | 0.76 | GNAO1 (0.40) | — | |
| SCHEMBL11969012 | 0.74 | OPRD1 (0.30) | — | |
| SCHEMBL361683 | 0.73 | — | — | |
| SCHEMBL9326124 | 0.73 | — | — |
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 942 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024150963-A1 | NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | 광주과학기술원 | 2024-07-18 | — | — | WO | claimed |
| CN-118047726-A | Ferulic acid ester analogues, preparation method and application thereof | 西北大学 | 2024-05-17 | — | — | CN | claimed |
| CN-117886798-A | Substituted benzimidazoles and use thereof | 河南中医药大学 | 2024-04-16 | — | — | CN | claimed |
| CN-117794923-A | Benzodioxane compound, and preparation method and application thereof | 南京红云生物科技有限公司 | 2024-03-29 | — | — | CN | claimed |
| CN-114920722-B | 7-hydroxy-3-acetyl coumarin oxime compound, preparation method and medical application thereof | 何黎琴 | 2024-03-08 | — | — | CN | claimed |
| CN-117645647-A | Tripterine derivative, preparation method and medical application thereof | 安徽中医药大学 | 2024-03-05 | — | — | CN | claimed |
| CN-117586246-A | NO donor coumarin Mannich base compound and preparation method and application thereof | 安徽中医药大学 | 2024-02-23 | — | — | CN | claimed |
| CN-117567303-A | Chalcone Mannich base compound, pharmaceutical composition, preparation method and application thereof | 安徽中医药大学 | 2024-02-20 | — | — | CN | claimed |
| CN-117510413-A | DCLK1 kinase inhibitor and preparation method and application thereof | 杭州医学院 | 2024-02-06 | — | — | CN | claimed |
| US-20230310428-A1 | EGFR INHIBITOR AND PREPARATION METHOD AND USE THEREOF | Hongyun Biotech Co., Ltd. (CN) | 2023-10-05 | — | — | US | claimed |
| US-4857535-A | THIOESTERS | UNITED PHARMACEUTICALS (US) | 1989-08-15 | — | — | US | claimed |
| EP-0221384-B1 | VULCANIZABLE RUBBER COMPOSITION AND ITS VULCANIZATION | BAYER AG (DE) | 1989-07-26 | — | — | EP | claimed |
| CN-1003236-B | Preparation method of 6, 7-disubstituted-1-cyclopropyl-1, 4-dihydro-4-oxo-1, 8-naphthyridine-3-carboxylic acid | 拜尔公司 | 1989-02-08 | — | — | CN | claimed |
| US-4721783-A | SMOOTH MUSCLES | UNITED PHARMACEUTICALS, INC. (US) | 1988-01-26 | — | — | US | claimed |
| EP-0221384-A1 | Vulcanizable rubber composition and its vulcanization | BAYER AG (DE) | 1987-05-13 | — | — | EP | claimed |
| US-4650868-A | 7-deazapurine derivatives useful as antitumor agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1987-03-17 | — | — | US | claimed |
| US-4595530-A | Thiodeazapurine derivatives | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1986-06-17 | — | — | US | claimed |
| US-4279912-A | ANTIALLERGENS, BRONCHODILATORS | ROUSSEL UCLAF (FR) | 1981-07-21 | — | — | US | claimed |
| US-4091115-A | ANTIDEPRESSANTS | ROUSSEL UCLAF (FR) | 1978-05-23 | — | — | US | claimed |
| US-4069064-A | Phthalocyanine formulations having high gloss, which are stabilized against recrystallization and against change of modification | BASF AKTIENGESELLSCHAFT (DT) | 1978-01-17 | — | — | US | claimed |