⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1046368 | 1.00 | — | — | |
| SCHEMBL4536370 | 1.00 | — | — | |
| Iodide SCHEMBL23540723 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL4239509 | 0.96 | — | — | |
| SCHEMBL3565343 | 0.80 | SLC1A3 (0.33) | — | |
| SCHEMBL18883028 | 0.78 | — | — | |
| Isopropylamine SCHEMBL10634731 | 0.73 | — | — | |
| Isobutyraldehyde SCHEMBL6841306 | 0.73 | — | — | |
| SCHEMBL16548260 | 0.72 | — | — | |
| SCHEMBL7029259 | 0.72 | — | — |
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 758 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117503776-A | Pharmaceutical composition and application thereof | 临港国家实验室 | 2024-02-06 | — | — | CN | claimed |
| US-20230257354-A1 | NOVEL HETEROCYCLIC COMPOUNDS | HOFFMANN-LA ROCHE INC. (US) | 2023-08-17 | — | — | US | claimed |
| EP-4211116-A1 | NOVEL HETEROCYCLIC ANTIBIOTICS | F. Hoffmann-La Roche AG (CH) | 2023-07-19 | — | — | EP | claimed |
| US-20230167109-A1 | Aminopiperidine Amides, Derivatives, Compositions, and Uses Related to CXCR4 Modulation | UNIV EMORY (US) | 2023-06-01 | — | — | US | claimed |
| WO-2021217143-A1 | AMINOPIPERIDINE AMIDES, DERIVATIVES, COMPOSITIONS, AND USES RELATED TO CXCR4 MODULATION | EMORY UNIVERSITY (US) | 2021-10-28 | — | — | WO | claimed |
| EP-3836971-A1 | CONJUGATES AND METHODS OF USING THE SAME | Flagship Pioneering Innovations V, Inc. (US) | 2021-06-23 | — | — | EP | claimed |
| US-11040028-B2 | Penicinotam derivative, preparation method and use thereof | OCEAN UNIVERSITY OF CHINA (CN) | 2021-06-22 | — | — | US | claimed |
| US-20210162057-A1 | CONJUGATES AND METHODS OF USING THE SAME | FLAGSHIP PIONEERING INNOVATIONS V, INC. | 2021-06-03 | — | — | US | claimed |
| US-20210008045-A1 | PANICINOTAM DERIVATIVE, PREPARATION METHOD AND USE THEREOF | OCEAN UNIVERSITY OF CHINA (CN) | 2021-01-14 | — | — | US | claimed |
| CN-111747967-A | Dihydroartemisinin/neurotransmitter split compound and its synthesis method and use | 广州药本君安医药科技股份有限公司 | 2020-10-09 | — | — | CN | claimed |
| EP-0433034-B1 | Method involving thermally sensitive alpha-amidoacetyl or beta-amidopropionyl linkages | MINNESOTA MINING & MFG (US) | 1996-09-11 | — | — | EP | claimed |
| US-5399763-A | Process for preparing optically active 2-aminopropanal | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1995-03-21 | — | — | US | claimed |
| EP-0609689-A1 | Process for preparing optically active 2-aminopropanal | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1994-08-10 | — | — | EP | claimed |
| EP-0459675-B1 | Adhesive organopolysiloxane composition | SHINETSU CHEMICAL CO (JP) | 1994-08-03 | — | — | EP | claimed |
| EP-0366004-B1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | BOEHRINGER MANNHEIM GMBH (DE) | 1994-03-30 | — | — | EP | claimed |
| EP-0217804-B1 | ANALOGS OF SUBSTANCES P | ENICHEM S.p.A. (IT) | 1991-10-02 | — | — | EP | claimed |
| EP-0433034-A2 | Method involving thermally sensitive alpha-amidoacetyl or beta-amidopropionyl linkages | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1991-06-19 | — | — | EP | claimed |
| EP-0366004-A1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | Roche Diagnostics GmbH (DE) | 1990-05-02 | — | — | EP | claimed |
| EP-0217804-A1 | ANALOGS OF SUBSTANCES P. | ENICHEM SPA (IT) | 1987-04-15 | — | — | EP | claimed |
| WO-1986003495-A2 | DERIVATIVES OF SUBSTANCES P AND OF FRAGMENTS THEREOF | ENICHEM S.P.A. (IT) | 1986-06-19 | — | — | WO | claimed |