⚠ 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 SCHEMBL29125369 | 0.97 | — | — | |
| SCHEMBL16612023 | 0.89 | — | — | |
| SCHEMBL28318132 | 0.85 | ALDH1A1 (0.36) | — | |
| Tetrahydrofuran-3-Carbaldehyde SCHEMBL21581981 | 0.82 | — | — | |
| SCHEMBL28318135 | 0.82 | ALDH1A1 (0.37) | — | |
| Tetrahydrofuran-3-Carbaldehyde SCHEMBL67754 | 0.82 | — | — | |
| Tetrahydrofuran-3-Carbaldehyde SCHEMBL25907361 | 0.82 | — | — | |
| SCHEMBL17550016 | 0.80 | ALDH1A1 (0.35) | — | |
| Tetrahydrofuran-3-Carbaldehyde SCHEMBL28643418 | 0.80 | — | — | |
| Tetrahydrofuran-3-Carbaldehyde SCHEMBL28110770 | 0.80 | — | — |
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 2981 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 |
|---|---|---|---|---|---|---|---|
| CN-115746071-B | Mountain nuciferine glycoside derivative or pharmaceutically acceptable derivative or analogue thereof, and preparation method and application thereof | 上海交通大学医学院附属第九人民医院 | 2025-03-18 | — | — | CN | claimed |
| EP-4013755-B1 | PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS | NOVARTIS AG (CH) | 2025-01-08 | — | — | EP | claimed |
| CN-110914271-B | Bicyclic ketone compounds and methods of use thereof | 豪夫迈·罗氏有限公司 | 2024-12-10 | — | — | CN | claimed |
| WO-2024240118-A1 | PREPARATION FOR AND USE OF HETEROARYL DERIVATIVES | 广州智睿医药科技有限公司 | 2024-11-28 | — | — | WO | claimed |
| CN-119019454-A | Preparation and application of heteroaryl derivative | 广州智睿医药科技有限公司 | 2024-11-26 | — | — | CN | claimed |
| CN-118580246-A | Water-soluble tetrahydropyranyl molecular cup macrocyclic host compound and preparation and application thereof | 上海大学 | 2024-09-03 | — | — | CN | claimed |
| WO-2024114814-A1 | JAK INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS | ONQUALITY PHARMACEUTICALS CHINA LTD (CN) | 2024-06-06 | — | — | WO | claimed |
| CN-116867782-A | Pyrazole amide derivative | 豪夫迈·罗氏有限公司 | 2023-10-10 | — | — | CN | claimed |
| WO-2023125737-A1 | HETEROCYCLIC COMPOUNDS AND USE THEREOF | SILEXON AI TECHNOLOGY CO., LTD. (CN) | 2023-07-06 | — | — | WO | claimed |
| CN-115746071-A | Diphyllin glucoside derivative or pharmaceutically acceptable derivative or analogue thereof, and preparation method and application thereof | 上海交通大学医学院附属第九人民医院 | 2023-03-07 | — | — | CN | claimed |
| WO-2000000456-A1 | PREPARATION OF AN ALDOL USING A BASE-MODIFIED CLAY CATALYST | EASTMAN CHEMICAL COMPANY (US) | 2000-01-06 | — | — | WO | claimed |
| EP-0763030-B1 | PROCESS FOR PREPARING HETEROCYCLIC ALDEHYDES | BASF AG (DE) | 1999-01-07 | — | — | EP | claimed |
| US-5783711-A | CATALYTIC HYDROGENATION OF HETEROCYCLIC CARBOXYLIC ACIDS;INTERMEDIATES FOR HERBICIDES OF THE CYCLOHEXANONE CLASS | BASF AKTIENGESELLSCHAFT (DE) | 1998-07-21 | — | — | US | claimed |
| EP-0763030-A1 | PROCESS FOR PREPARING HETEROCYCLIC ALDEHYDES | BASF AKTIENGESELLSCHAFT (DE) | 1997-03-19 | — | — | EP | claimed |
| WO-1995033741-A1 | PROCESS FOR PREPARING HETEROCYCLIC ALDEHYDES | BASF AKTIENGESELLSCHAFT (DE) | 1995-12-14 | — | — | WO | claimed |
| EP-0454867-B1 | A METHOD FOR THE SYNTHESIS OF $g(a), $g(b)-UNSATURATED KETONES | NIPPON SODA CO (JP) | 1995-02-01 | — | — | EP | claimed |
| EP-0259814-B1 | PROCESS FOR THE PRODUCTION OF 4-FORMYL TETRAHYDROPYRANES, AND 4-FORMYL TETRAHYDROPYRANES | BASF Aktiengesellschaft (DE) | 1989-12-13 | — | — | EP | claimed |
| US-4824973-A | Preparation of 4-formyltetrahydropyrans | BASF AKTIENGESELLSCHAFT (DE) | 1989-04-25 | — | — | US | claimed |
| EP-0259814-A1 | Process for the production of 4-formyl tetrahydropyranes, and 4-formyl tetrahydropyranes | BASF Aktiengesellschaft (DE) | 1988-03-16 | — | — | EP | claimed |
| US-4618362-A | USING CYCLOHEXAN-1,3-DIONE DERIVATIVE | BASF AKTIENGESELLSCHAFT (DE) | 1986-10-21 | — | — | US | claimed |