⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29942277 | 0.97 | ALDH1A1 (0.43) | — | |
| SCHEMBL38660928 | 0.95 | ALDH1A1 (0.41) | — | |
| SCHEMBL95534 | 0.78 | ALDH1A1 (0.41) | — | |
| SCHEMBL7754354 | 0.75 | ALDH1A1 (0.50) | — | |
| SCHEMBL8029164 | 0.75 | ALDH1A1 (0.50) | — | |
| SCHEMBL5609745 | 0.74 | ACHE (0.44) | — | |
| SCHEMBL3466698 | 0.74 | ALDH1A1 (0.41) | — | |
| SCHEMBL49576 | 0.74 | LTA4H (0.38) | — | |
| SCHEMBL96272 | 0.72 | LTA4H (0.38) | — | |
| SCHEMBL3525971 | 0.72 | HTR3E (0.50) | — |
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 2907 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 |
|---|---|---|---|---|---|---|---|
| US-20240239775-A1 | FXR REGULATOR, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | BEIJING BEST PATHWAY MANAGEMENT CONSULTING CENTER (LIMITED PARTNERSHIP) (CN) | 2024-07-18 | — | — | US | claimed |
| US-20240199542-A1 | SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | BAYER AKTIENGESELLSCHAFT (DE) | 2024-06-20 | — | — | US | claimed |
| EP-4324825-A1 | FXR REGULATOR, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF | Beijing Best Pathway Management Consulting Center (Limited Partnership) (CN) | 2024-02-21 | — | — | EP | claimed |
| EP-4313943-A1 | SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | Bayer Aktiengesellschaft (DE) | 2024-02-07 | — | — | EP | claimed |
| CN-117342910-A | Preparation method of monosubstituted cyclopentadiene | 江苏南大光电材料股份有限公司 | 2024-01-05 | — | — | CN | claimed |
| CN-117024456-A | Condensed cyclic compound, material containing the same, and organic electroluminescent device | 中国科学院理化技术研究所 | 2023-11-10 | — | — | CN | claimed |
| US-20230150924-A1 | NOVEL COMPOUND HAVING CANCER METASTASIS INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR INHIBITING CANCER METASTASIS AND INVASION OR TREATING COLORECTAL CANCER, COMPRISING COMPOUND | CELLGENTEK CO., LTD. (KR) | 2023-05-18 | — | — | US | claimed |
| CN-116019794-A | Application of amino fullerene material in preparation of exosome PD-L1 inhibition drugs | 中国科学院化学研究所 | 2023-04-28 | — | — | CN | claimed |
| US-20230104878-A1 | VEHICLE HEADLIGHT ASSEMBLY | DUPONT POLYMERS, INC. | 2023-04-06 | — | — | US | claimed |
| CN-114345339-B | Supported binary metal catalyst, preparation method and application thereof | 厦门大学 | 2023-02-21 | — | — | CN | claimed |
| EP-0004624-B1 | CHROMANON DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICINES AND GROWTH-PROMOTING AGENTS | BAYER AG (DE) | 1982-02-24 | — | — | EP | claimed |
| US-4257946-A | Benzodiazepine intermediates for the preparation of imidazobenzodiazepines | HOFFMANN-LA ROCHE INC. (US) | 1981-03-24 | — | — | US | claimed |
| US-4211436-A | Pressure-sensitive recording material | BAYER AKTIENGESELLSCHAFT (DE) | 1980-07-08 | — | — | US | claimed |
| US-4139530-A | CATIONIC DYES | BAYER AKTIENGESELLSCHAFT (DE) | 1979-02-13 | — | — | US | claimed |
| US-4122089-A | Aminothiofluoran compounds, process for the production thereof, and recording elements containing the same | SANKIO CHEMICAL CO., LTD. (JP) | 1978-10-24 | — | — | US | claimed |
| US-4042642-A | 1,3-BIS(MORPHOLINOTHIO)-IMIDAZOLIDINONE | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1977-08-16 | — | — | US | claimed |
| US-4041054-A | Process for the preparation of symmetric 4-halogen-4',4\"-diarylamino-triphenylmethane compounds | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-08-09 | — | — | US | claimed |
| US-4016263-A | BACTERICIDES | BOEHRINGER INGELHEIM GMBH (DT) | 1977-04-05 | — | — | US | claimed |
| US-3998805-A | MONOAZO DYES; POLYESTERS; YELLOW, RED, OR ORANGE SHADES | CIBA-GEIGY CORPORATION (US) | 1976-12-21 | — | — | US | claimed |
| US-3960857-A | Urea additives for sulfur vulcanizable polymers | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1976-06-01 | — | — | US | claimed |