⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9264281 | 0.73 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL4481319 | 0.67 | ALDH1A1 (0.44) | — | |
| 2,2,3-Trimethylbutane SCHEMBL122284 | 0.67 | — | — | |
| SCHEMBL4536615 | 0.65 | — | — | |
| SCHEMBL19264 | 0.65 | — | — | |
| SCHEMBL582319 | 0.63 | — | — | |
| SCHEMBL9130423 | 0.63 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL30565590 | 0.63 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL1788862 | 0.63 | — | — | |
| 2,2,3-Trimethylbutane SCHEMBL30369120 | 0.63 | — | — |
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 1622 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240239755-A1 | SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | BAYER AKTIENGESELLSCHAFT (DE) | 2024-07-18 | — | — | US | disclosed |
| WO-2024140700-A1 | BENZOTHIAZOLE COMPOUND, AND SYNTHESIS THEREFOR AND USE THEREOF | 西北农林科技大学 | 2024-07-04 | — | — | WO | disclosed |
| EP-4391808-A1 | HERBICIDAL MALONAMIDES | BASF SE (DE) | 2024-07-03 | — | — | EP | disclosed |
| EP-4058450-B1 | 4-(4-(4,5-DIHYDROISOXAZOL-3-YL)THIAZOL-2-YL)PIPERIDINE SULFILIMINE AND SULFOXIMINE DERIVATIVES AND RELATED COMPOUNDS AS FUNGICIDES FOR CROP PROTECTION | PI INDUSTRIES LTD (IN) | 2024-07-03 | — | — | EP | disclosed |
| US-12024510-B2 | Pyrazolopyridine-diamides, their use as insecticide and processes for preparing the same | PI INDUSTRIES LTD. (IN) | 2024-07-02 | — | — | US | disclosed |
| EP-4387970-A1 | SUBSTITUTED 1,2,4-THIADIAZOLYL NICOTINAMIDES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | Bayer Aktiengesellschaft (DE) | 2024-06-26 | — | — | EP | disclosed |
| US-12018267-B2 | Plants having increased tolerance to herbicides | BASF SE (DE) | 2024-06-25 | — | — | US | disclosed |
| US-20240199600-A1 | CONDENSED HETEROCYCLIC COMPOUND HAVING A SULFONAMIDE GROUP OR SALT THEREOF, AGRICULTURAL OR HORTICULTURAL INSECTICIDE OR ANIMAL ECTOPARASITE OR ENDOPARASITE CONTROL AGENT COMPRISING THE COMPOUND OR THE SALT THEREOF, AND METHOD FOR USING THE COMPOUND OR THE SALT THEREOF, THE INSECTICIDE, OR THE CONTROL AGENT | NIHON NOHYAKU CO., LTD. (JP) | 2024-06-20 | — | — | US | disclosed |
| US-20240199542-A1 | SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | BAYER AKTIENGESELLSCHAFT (DE) | 2024-06-20 | — | — | US | disclosed |
| US-12010995-B2 | Oxadiazoline compounds or salts thereof, agrohorticultural fungicides containing the compounds, and methods of using the same | NIHON NOHYAKU CO., LTD. (JP) | 2024-06-18 | — | — | US | disclosed |
| WO-1994011344-A1 | SUBSTITUTED 3,4,5,6-TETRAHYDROPHTHALIMIDES FOR USE AS HERBICIDES AND/OR DEFOLIANTS OR DESICCANTS | BASF AKTIENGESELLSCHAFT (DE) | 1994-05-26 | — | — | WO | disclosed |
| US-5298527-A | Insecticides | BASF AKTIENGESELLSCHAFT (DE) | 1994-03-29 | — | — | US | disclosed |
| WO-1993022280-A1 | SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-11 | — | — | WO | disclosed |
| US-5254717-A | Imino-substituted phenyl derivatives, the preparation thereof and fungicides containing these | BASF AKTIENGESELLSCHAFT (DE) | 1993-10-19 | — | — | US | disclosed |
| WO-1993016985-A1 | CYANO-OXIME ETHERS, PROCESS FOR PRODUCING THEM, AGENTS CONTAINING THEM AND THEIR USE | BASF AKTIENGESELLSCHAFT (DE) | 1993-09-02 | — | — | WO | disclosed |
| EP-0537463-A2 | Substituted pyrido(2,3-d)pyrimidines as antidotes | BASF Aktiengesellschaft (DE) | 1993-04-21 | — | — | EP | disclosed |
| WO-1993006090-A1 | SUBSTITUTED 3-PHENYLURACILS AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1993-04-01 | — | — | WO | disclosed |
| WO-1993005053-A1 | PROCESS FOR PRODUCING α-CHLOR-METHYLEN-TRIORGANYLPHOSPHORANE DERIVATES | BASF AKTIENGESELLSCHAFT (DE) | 1993-03-18 | — | — | WO | disclosed |
| EP-0513580-A2 | Alpha-phenyl-acrylic acid derivatives, process for their preparation and their use as parasiticides and fungicides | BASF Aktiengesellschaft (DE) | 1992-11-19 | — | — | EP | disclosed |
| EP-0499823-A2 | Imino-substituted phenyl derivatives, their preparation and fungicides containing them | BASF Aktiengesellschaft (DE) | 1992-08-26 | — | — | EP | disclosed |