⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL29902372 | 0.98 | HCAR2 (0.39) | — | |
| SCHEMBL28254929 | 0.93 | HCAR2 (0.38) | — | |
| Trifluoroacetic Acid SCHEMBL8589471 | 0.89 | HCAR2 (0.32) | — | |
| SCHEMBL3468250 | 0.86 | CA1 (0.32) | — | |
| SCHEMBL24447 | 0.86 | — | — | |
| SCHEMBL3467847 | 0.84 | — | — | |
| SCHEMBL11126262 | 0.80 | — | — | |
| SCHEMBL1938924 | 0.80 | — | — | |
| SCHEMBL29044988 | 0.77 | HDAC6 (0.47) | — | |
| SCHEMBL7749784 | 0.75 | ALDH1A1 (0.38) | — |
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 80 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8802678-B2 | Carbonylated (aza) cyclohexanes as dopamine D3 receptor ligands | BIOPROJET (FR) | 2014-08-12 | — | — | US | claimed |
| US-20090286801-A1 | CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS | BIOPROJET (FR) | 2009-11-19 | — | — | US | claimed |
| EP-2038268-A2 | CARBONYLATED (AZA)CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS | BIOPROJET (FR) | 2009-03-25 | — | — | EP | claimed |
| WO-2007148208-A2 | CARBONYLATED (AZA) CYCLOHEXANES AS DOPAMINE D3 RECEPTOR LIGANDS | BIOPROJET (FR) | 2007-12-27 | — | — | WO | claimed |
| EP-0159993-A4 | PREPARATION OF 6-CARBOXY-3,4-DIHYDRO-2H-PYRAN. | ETHYL CORP (US) | 1987-01-20 | — | — | EP | claimed |
| US-4599435-A | Preparation of 6-carboxy-3,4-dihydro-2H-pyran | ETHYL CORPORATION (US) | 1986-07-08 | — | — | US | claimed |
| EP-0159993-A1 | PREPARATION OF 6-CARBOXY-3,4-DIHYDRO-2H-PYRAN | ETHYL CORPORATION (US) | 1985-11-06 | — | — | EP | claimed |
| WO-1985001731-A1 | PREPARATION OF 6-CARBOXY-3,4-DIHYDRO-2H-PYRAN | ETHYL CORPORATION (US) | 1985-04-25 | — | — | WO | claimed |
| CN-122055148-A | Conjugates, compositions and methods for treating influenza | 珀杜研究基金会 | 2026-05-15 | — | — | CN | disclosed |
| CN-114907301-B | Ranitivir octanoate intermediate and preparation method thereof | 上海医药工业研究院 | 2024-05-28 | — | — | CN | disclosed |
| CN-117717059-A | Platelet preservation solution and preparation method and application thereof | 河络新图生物科技(上海)有限公司 | 2024-03-19 | — | — | CN | disclosed |
| CN-112898224-B | Allyl alcohol-supported macrolide compound and application thereof | 中国科学院上海药物研究所 | 2023-02-17 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| CN-114907301-A | Ranitivir caprylate intermediate and preparation method thereof | 上海医药工业研究院 | 2022-08-16 | — | — | CN | disclosed |
| US-4599435-A | Preparation of 6-carboxy-3,4-dihydro-2H-pyran | ETHYL CORPORATION (US) | 1986-07-08 | — | — | US | disclosed |
| EP-0159993-A1 | PREPARATION OF 6-CARBOXY-3,4-DIHYDRO-2H-PYRAN | ETHYL CORPORATION (US) | 1985-11-06 | — | — | EP | disclosed |
| EP-0159993-A1 | PREPARATION OF 6-CARBOXY-3,4-DIHYDRO-2H-PYRAN | ETHYL CORPORATION (US) | 1985-11-06 | — | — | EP | disclosed |
| US-4544505-A | Preparation of halo-α-keto-carboxylic acids | ETHYL CORPORATION (US) | 1985-10-01 | — | — | US | disclosed |
| WO-1985001731-A1 | PREPARATION OF 6-CARBOXY-3,4-DIHYDRO-2H-PYRAN | ETHYL CORPORATION (US) | 1985-04-25 | — | — | WO | disclosed |
| WO-1985001731-A1 | PREPARATION OF 6-CARBOXY-3,4-DIHYDRO-2H-PYRAN | ETHYL CORPORATION (US) | 1985-04-25 | — | — | WO | disclosed |