⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL213368 | 1.00 | — | — | |
| SCHEMBL27606628 | 1.00 | ALDH1A1 (0.44) | — | |
| SCHEMBL57531 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL27345095 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL28089282 | 0.94 | — | — | |
| Acrylonitrile SCHEMBL27831408 | 0.89 | ALDH1A1 (0.47) | — | |
| SCHEMBL27918573 | 0.89 | TSHR (0.36) | — | |
| SCHEMBL9235214 | 0.87 | ALDH1A1 (0.33) | — | |
| SCHEMBL27649311 | 0.87 | ALDH1A1 (0.33) | — | |
| SCHEMBL9235218 | 0.87 | ALDH1A1 (0.33) | — |
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 2554 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-122011272-A | Soap-free emulsion polymerization method, polymer emulsion and application thereof | 重庆硕盈峰新材料科技有限公司 | 2026-05-12 | — | — | CN | claimed |
| US-12435033-B2 | Method and device for preparing adiponitrile | ZHEJIANG NHU COMPANY LTD (CN) | 2025-10-07 | — | — | US | claimed |
| EP-4600285-A1 | FOAMABLE POLYURETHANE COMPOSITION COMPRISING A NITRILE | Henkel AG & Co. KGaA (DE) | 2025-08-13 | — | — | EP | claimed |
| US-12374714-B2 | Non-aqueous electrolyte solution and lithium secondary battery comprising same | LG ENERGY SOLUTION, LTD. (KR) | 2025-07-29 | — | — | US | claimed |
| EP-4553914-A1 | NEGATIVE ELECTRODE FOR RECHARGEABLE LITHIUM BATTERY AND RECHARGEABLE LITHIUM BATTERY INCLUDING THE SAME | SAMSUNG SDI CO., LTD. (KR) | 2025-05-14 | — | — | EP | claimed |
| CN-119965211-A | Negative electrode for rechargeable lithium battery and rechargeable lithium battery including the same | 三星SDI株式会社 | 2025-05-09 | — | — | CN | claimed |
| US-20250149738-A1 | NEGATIVE ELECTRODE FOR RECHARGEABLE LITHIUM BATTERY AND RECHARGEABLE LITHIUM BATTERY INCLUDING THE SAME | SAMSUNG SDI CO., LTD. (KR) | 2025-05-08 | — | — | US | claimed |
| CN-119930903-A | Acrylic resin for wafer dicing tape and preparation method thereof | 深圳先进电子材料国际创新研究院 | 2025-05-06 | — | — | CN | claimed |
| US-20250136561-A1 | COMPOSITIONS OF MATTER FROM UNSATURATED NITRILES | INV NYLON CHEMICALS AMERICAS, LLC | 2025-05-01 | — | — | US | claimed |
| CN-119866561-A | Electrochemical device and electronic device | 宁德新能源科技有限公司 | 2025-04-22 | — | — | CN | claimed |
| EP-0449297-A2 | Cyanobutylation of amines with 2-pentenenitrile | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-10-02 | — | — | EP | claimed |
| EP-0177272-B1 | MANUFACTURE OF PYRIDINE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-09-05 | — | — | EP | claimed |
| US-4950778-A | REACTING PENTENENITRILE, CARBON MONOXIDE AND WATER OR ALCOHOL IN PRESENCE OF COBALT-CONTAINING CARBONYLATION CATALYST | E. I. DU PONT DE NEMOURS & COMPANY (US) | 1990-08-21 | — | — | US | claimed |
| EP-0377838-A1 | Manufacture of 5-cyanovaleric acid and its esters | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-07-18 | — | — | EP | claimed |
| US-4941954-A | Electrochemical preparation of branched unsaturated dinitriles | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-07-17 | — | — | US | claimed |
| EP-0373579-A1 | Manufacture of 5-cyanovaleric acid and its esters using cyclic cosolvents | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-06-20 | — | — | EP | claimed |
| US-4933483-A | Manufacture of 5-cyanovaleric acid and its esters | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-06-12 | — | — | US | claimed |
| EP-0015385-B1 | PROCESS FOR THE PREPARATION OF N-PROPYL- AND N-ETHYLCYANOACETIC ACID ESTERS | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1982-05-12 | — | — | EP | claimed |
| US-4260556-A | Process for preparing nitrogen-containing compounds from 2-pentenenitrile | MILLIKEN RESEARCH CORPORATION (US) | 1981-04-07 | — | — | US | claimed |
| US-4080374-A | SOLVENT EXTRACTION USING ORGANIC NITRILES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-03-21 | — | — | US | claimed |