⚠ 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 SCHEMBL27978928 | 0.97 | — | — | |
| Methyl Alcohol SCHEMBL28933567 | 0.94 | — | — | |
| SCHEMBL29140261 | 0.88 | TSHR (0.37) | — | |
| Boric Acid SCHEMBL27935960 | 0.88 | TSHR (0.30) | — | |
| SCHEMBL29007551 | 0.86 | TSHR (0.33) | — | |
| SCHEMBL10110871 | 0.76 | — | — | |
| SCHEMBL13544222 | 0.76 | TSHR (0.30) | — | |
| SCHEMBL3626628 | 0.74 | — | — | |
| SCHEMBL3629035 | 0.74 | — | — | |
| SCHEMBL26318561 | 0.74 | — | — |
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 386 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4600285-A1 | FOAMABLE POLYURETHANE COMPOSITION COMPRISING A NITRILE | Henkel AG & Co. KGaA (DE) | 2025-08-13 | — | — | EP | claimed |
| CN-116348455-A | Protein tyrosine phosphatase inhibitors and methods of use thereof | 卡里科生命科学有限责任公司 | 2023-06-27 | — | — | CN | claimed |
| CN-112521310-B | 2,2-dimethyl butyronitrile, derivative thereof and synthetic method | 河北诚信集团有限公司 | 2022-12-06 | — | — | CN | claimed |
| CN-112521310-A | 2, 2-dimethyl butyronitrile, derivative and synthetic method thereof | 河北诚信集团有限公司 | 2021-03-19 | — | — | CN | claimed |
| CN-108178724-B | Process for the preparation of compounds | 四川大学 | 2020-09-11 | — | — | CN | claimed |
| WO-2020007768-A1 | METHOD FOR SURFACE MODIFICATION OF INORGANIC MICROPARTICLES IN A SUPERCRITICAL CO2 MEDIUM | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2020-01-09 | — | — | WO | claimed |
| US-10202345-B2 | Substituted azaspiro(4.5)decane derivatives | GRUENENTHAL GMBH (DE) | 2019-02-12 | — | — | US | claimed |
| EP-3169665-A1 | SUBSTITUTED AZA-SPIRO(4.5)DECAN-DERIVATIVES | Grünenthal GmbH (DE) | 2017-05-24 | — | — | EP | claimed |
| WO-2016008583-A1 | SUBSTITUTED AZA-SPIRO(4.5)DECAN-DERIVATIVES | Grünenthal GmbH (DE) | 2016-01-21 | — | — | WO | claimed |
| CN-104371054-A | Preparation method of high-molecular-weight anionic polyacrylamide | ANHUI TIANRUN CHEMICALS CO LTD | 2015-02-25 | — | — | CN | claimed |
| US-20080139588-A1 | Pyrrolo[2,3-d]pyrimidine cytokine inhibitors | THE PROCTER & GAMBLE COMPANY | 2008-06-12 | — | — | US | claimed |
| EP-1242353-A1 | PROCESS FOR THE RECOVERY AND RECYCLE OF D-TARTARIC ACID | BASF AKTIENGESELLSCHAFT (DE) | 2002-09-25 | — | — | EP | claimed |
| WO-2001047856-A1 | PROCESS FOR THE RECOVERY AND RECYCLE OF D-TARTARIC ACID | BASF AKTIENGESELLSCHAFT (DE) | 2001-07-05 | — | — | WO | claimed |
| EP-4600285-A1 | FOAMABLE POLYURETHANE COMPOSITION COMPRISING A NITRILE | Henkel AG & Co. KGaA (DE) | 2025-08-13 | — | — | EP | disclosed |
| WO-2025132542-A1 | MACROCYCLIC OREXIN AGONISTS | IDORSIA PHARMACEUTICALS LTD (CH) | 2025-06-26 | — | — | WO | disclosed |
| US-12261265-B2 | Method for producing lithium fluorosulfonate, lithium fluorosulfonate, nonaqueous electrolytic solution, and nonaqueous electrolytic solution secondary battery | MITSUBISHI CHEMICAL CORPORATION (JP) | 2025-03-25 | — | — | US | disclosed |
| EP-0227415-A2 | Pyrimidine derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-07-01 | — | — | EP | disclosed |
| EP-0208921-A2 | Hydroformylation of olefinic compounds in the presence of soluble cobalt salt catalysts and an organic nitrile promoter | HENKEL CORPORATION (a Delaware corp.) (US) | 1987-01-21 | — | — | EP | disclosed |
| US-4612403-A | Hydroformylation of olefinic compounds in the presence of a cobalt catalyst and an organic nitrile promoter | HENKEL CORPORATION (US) | 1986-09-16 | — | — | US | disclosed |
| US-4219684-A | REACTION OF AN OLEFIN WITH CARBON MONOXIDE AND HYDROGEN | UOP INC. (US) | 1980-08-26 | — | — | US | disclosed |