⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10598384 | 0.97 | CA1 (0.65) | — | |
| SCHEMBL20913241 | 0.97 | CA1 (0.65) | — | |
| SCHEMBL2096923 | 0.92 | LTA4H (0.61) | — | |
| SCHEMBL2093349 | 0.92 | ESR2 (0.58) | — | |
| SCHEMBL8438727 | 0.87 | HPGD (0.55) | — | |
| SCHEMBL8582803 | 0.85 | APP (0.63) | — | |
| SCHEMBL2017201 | 0.85 | PTGS2 (0.53) | — | |
| SCHEMBL40356 | 0.85 | PTGS2 (0.53) | — | |
| SCHEMBL6291456 | 0.85 | LTA4H (0.65) | — | |
| 1,4-Dimethoxybenzene SCHEMBL8489 | 0.83 | CA1 (1.00) | — |
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
Appears in 73914 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6384031-B1 | — | — | None | — | — | US | claimed |
| CN-114644568-B | Purification method of sitagliptin intermediate | 浙江医药股份有限公司新昌制药厂 | 2024-07-19 | — | — | CN | claimed |
| WO-2024149366-A1 | METHOD FOR PREPARING INTERMEDIATE OF ROCK INHIBITOR | 武汉朗来科技发展有限公司 | 2024-07-18 | — | — | WO | claimed |
| US-20240240114-A1 | Improved Combination of Protease and Protease Inhibitor with Secondary Enzyme | BASF SE (DE) | 2024-07-18 | — | — | US | claimed |
| EP-4039690-B1 | A SUBSTANTIALLY DIASTEREOMERICALLY PURE PHOSPHORAMIDOCHLORIDATE, A METHOD AND A PHARMACEUTICAL COMPOSITION | EISAI R&D MAN CO LTD (JP) | 2024-07-17 | — | — | EP | claimed |
| EP-4399212-A1 | SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | Bayer Aktiengesellschaft (DE) | 2024-07-17 | — | — | EP | claimed |
| EP-4399206-A1 | PAPD5 AND/OR PAPD7 INHIBITING 4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID DERIVATIVES | Redona Therapeutics, Inc. (US) | 2024-07-17 | — | — | EP | claimed |
| CN-118344265-A | Amide compound and preparation method and application thereof | 河北大学 | 2024-07-16 | — | — | CN | claimed |
| CN-118344340-A | Quinolinone compound containing 1,2, 4-triazole or 1,3, 4-oxadiazole structure and preparation and application thereof | 贵州大学 | 2024-07-16 | — | — | CN | claimed |
| CN-118324695-A | Method for selectively preparing quinoline-2-ketone or 3, 4-dihydro-quinoline-2-ketone compound under regulation of photocatalyst | 浙江工业大学 | 2024-07-12 | — | — | CN | claimed |
| US-3957811-A | Process for 3-(1-[arylmethyl]tetrazol-5-yl)penams | PFIZER INC. (US) | 1976-05-18 | — | — | US | claimed |
| US-3953436-A | 3,4-Dicarboxycephalosporins and derivatives | ELI LILLY AND COMPANY (US) | 1976-04-27 | — | — | US | claimed |
| US-3946005-A | BACTERICIDES | SMITHKLINE CORPORATION (US) | 1976-03-23 | — | — | US | claimed |
| US-3943129-A | BACTERICIDE | SMITHKLINE CORPORATION (US) | 1976-03-09 | — | — | US | claimed |
| US-3943126-A | Process for acylating a 7-aminocephalosporin | ELI LILLY AND COMPANY (US) | 1976-03-09 | — | — | US | claimed |
| US-3936446-A | Isocyanocephalosporanates | BEECHAM GROUP LIMITED (DT) | 1976-02-03 | — | — | US | claimed |
| US-3936447-A | 7-Acylamino-desacetoxy-cephalosporanic acid esters and their production | BAYER AKTIENGESELLSCHAFT (DT) | 1976-02-03 | — | — | US | claimed |
| US-3932393-A | 3-Methylenecephalosporins and process for production thereof | ELI LILLY AND COMPANY (US) | 1976-01-13 | — | — | US | claimed |
| US-3932387-A | Process for the conversion of 3-methyl-3-hydroxycepham compounds | ELI LILLY AND COMPANY (US) | 1976-01-13 | — | — | US | claimed |
| US-3931140-A | (H-gly-gly-tyr-ala)1 -somatostatin | AMERICAN HOME PRODUCTS CORPORATION (US) | 1976-01-06 | — | — | US | claimed |