⚠ 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 SCHEMBL28591541 | 0.95 | — | — | |
| SCHEMBL41780 | 0.71 | — | — | |
| Fluoride SCHEMBL27920001 | 0.67 | — | — | |
| SCHEMBL14940573 | 0.59 | ALDH1A1 (0.30) | — | |
| SCHEMBL2406 | 0.59 | ALDH1A1 (0.30) | — | |
| SCHEMBL28558299 | 0.56 | — | — | |
| Water SCHEMBL28911661 | 0.56 | — | — | |
| Iodide SCHEMBL20500202 | 0.56 | — | — | |
| Bromide SCHEMBL20500171 | 0.56 | — | — | |
| Fluoride SCHEMBL27640081 | 0.56 | — | — |
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 2317 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-117430540-A | Pyrrolidine compound and preparation method thereof | 上海艾力斯医药科技股份有限公司 | 2024-01-23 | — | — | CN | claimed |
| EP-3998304-A2 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SmartKem Limited (GB) | 2022-05-18 | — | — | EP | claimed |
| EP-2817355-B1 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SMARTKEM LTD (GB) | 2021-03-24 | — | — | EP | claimed |
| EP-2817356-B1 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SMARTKEM LTD (GB) | 2021-02-17 | — | — | EP | claimed |
| EP-2817354-B1 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SMARTKEM LTD (GB) | 2021-01-13 | — | — | EP | claimed |
| US-10833274-B2 | Organic semiconductor compositions | SMARTKEM LIMITED (GB) | 2020-11-10 | — | — | US | claimed |
| EP-2817357-B1 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SMARTKEM LTD (GB) | 2020-11-04 | — | — | EP | claimed |
| EP-2817351-B1 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SMARTKEM LTD (GB) | 2020-08-26 | — | — | EP | claimed |
| EP-2817352-B1 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SMARTKEM LTD (GB) | 2020-08-26 | — | — | EP | claimed |
| US-10707420-B2 | Polycyclic aromatic hydrocarbon copolymer-containing organic semiconductor compositions | SMARTKEM LIMITED (GB) | 2020-07-07 | — | — | US | claimed |
| EP-0189159-B1 | DERIVATIVES OF 13-BETA-ALKYL-MYLBEMYCIN FOR COMBATING ANIMAL AND PLANT PARASITES | CIBA-GEIGY AG (CH) | 1992-07-01 | — | — | EP | claimed |
| EP-0186043-B1 | MILBEMYCIN DERIVATIVES WITH PESTICIDE PROPERTIES | CIBA-GEIGY AG (CH) | 1991-06-19 | — | — | EP | claimed |
| EP-0409399-A1 | 3-keto HMG-COA reductase inhibitors | MERCK & CO. INC. (US) | 1991-01-23 | — | — | EP | claimed |
| US-4859657-A | Pesticides | CIBA-GEIGY CORPORATION (US) | 1989-08-22 | — | — | US | claimed |
| US-4857509-A | 13β-alkylmilbemycin derivatives for controlling parasites of animals and plants | CIBA-GEIGY CORPORATION (US) | 1989-08-15 | — | — | US | claimed |
| EP-0253378-A2 | 13-Beta-alkyl derivatives of S541-antibiotics for combating parasites in domestic animals and plants | CIBA-GEIGY AG (CH) | 1988-01-20 | — | — | EP | claimed |
| EP-0235085-A1 | 13-Beta-sugar derivatives of milbemycine, their preparation and use as ekto- and endo-parasitic agents for treatment of animals and plants | CIBA-GEIGY AG (CH) | 1987-09-02 | — | — | EP | claimed |
| EP-0189159-A2 | Derivatives of 13-beta-alkyl-mylbemycin for combating animal and plant parasites | CIBA-GEIGY AG (CH) | 1986-07-30 | — | — | EP | claimed |
| EP-0186043-A1 | Milbemycin derivatives with pesticide properties | CIBA-GEIGY AG (CH) | 1986-07-02 | — | — | EP | claimed |
| EP-0147852-A2 | Ectoparasiticidal and insecticidal product | CIBA-GEIGY AG (CH) | 1985-07-10 | — | — | EP | claimed |