⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8447074 | 0.96 | — | — | |
| SCHEMBL28011582 | 0.96 | — | — | |
| Acetic Acid SCHEMBL11342939 | 0.90 | FFAR3 (0.44) | — | |
| SCHEMBL10524317 | 0.87 | TSHR (0.41) | — | |
| Sulfuric Acid SCHEMBL7979664 | 0.87 | TSHR (0.41) | — | |
| Ethaneperoxoic Acid SCHEMBL4778093 | 0.85 | TSHR (0.39) | — | |
| SCHEMBL3271834 | 0.72 | TSHR (0.53) | — | |
| SCHEMBL26928 | 0.72 | — | — | |
| SCHEMBL29750669 | 0.72 | — | — | |
| SCHEMBL5570194 | 0.72 | — | — |
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 345 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117986893-B | Delignified bamboo fiber-walnut shell powder reinforced thermosetting resin composite material | 西南林业大学 | 2024-07-02 | — | — | CN | claimed |
| CN-117986893-A | Delignified bamboo fiber-walnut shell powder reinforced thermosetting resin composite material | 西南林业大学 | 2024-05-07 | — | — | CN | claimed |
| CN-117820807-A | Flame-retardant/anti-corrosion epoxy resin prepared by main and guest chemistry and preparation method thereof | 浙江万畅科技有限公司 | 2024-04-05 | — | — | CN | claimed |
| WO-2024059668-A2 | HYDROXYLAMINE-BASED EGFR INHIBITORS FOR TREATMENT OF CANCER WITH BRAIN METASTASES | UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) | 2024-03-21 | — | — | WO | claimed |
| CN-113773182-B | Method for synthesizing 6, 8-dichloro octanoate | 风火轮(上海)生物科技有限公司 | 2024-02-06 | — | — | CN | claimed |
| CN-116283570-A | One-pot synthesis of 6, 8-dichloro octanoic acid ester | 风火轮(上海)生物科技有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-116283573-A | Method for synthesizing 6-hydroxy-8-chlorooctanoic acid ethyl ester | 风火轮(上海)生物科技有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-113732298-B | Wood-based material loaded nano zero-valent iron-based reducing agent, and preparation method and application thereof | 华东师范大学 | 2022-08-19 | — | — | CN | claimed |
| CN-114891237-A | Corn bran biomass plastic capable of being industrially produced and applied and preparation method thereof | 西南林业大学 | 2022-08-12 | — | — | CN | claimed |
| US-20220204423-A1 | CASHEW NUT SHELL LIQUID BASED SUBSTITUTED CYCLOHEXENE DERIVATIVES AND USES THEREOF | CARDOLITE CORPORATION | 2022-06-30 | — | — | US | claimed |
| WO-2006070396-A1 | PROCESS FOR PRODUCING 1-BENZYL-4-[(5,6-DIMETHOXY-1-INDANON2-YL)METHYL] PIPERIDINE OR ITS SALT THEREOF VIA NOVEL INTERMEDIATE | JUBILANT ORGANOSYS LIMITED (IN) | 2006-07-06 | — | — | WO | claimed |
| EP-1023266-B1 | PROCESS FOR MAKING DIARYL PYRIDINES USEFUL AS COX-2 INHIBITORS | MERCK & CO INC (US) | 2003-01-08 | — | — | EP | claimed |
| US-6204387-B1 | FROM THE CORRESPONDING ORGANOMETALLIC COMPOUND; ANTIINFLAMMATORY AGENTS, ANTIPYRETICS, ANALGESICS | MERCK & CO., INC. | 2001-03-20 | — | — | US | claimed |
| EP-1023266-A2 | PROCESS FOR MAKING DIARYL PYRIDINES USEFUL AS COX-2 INHIBITORS | Merck & Co., Inc. (US) | 2000-08-02 | — | — | EP | claimed |
| US-6040450-A | REACTING BENZOSULFIDE DERIVATIVE WITH MAGNESIUM TO FORM A MAGNESIUM HALIDE CONTAINING BENZOSULFIDE DERIVATIVE, REACTING THE INTERMEDIATE WITH PYRIDINE DERIVATIVE TO FORM INTERMEDIATE, OXIDIZING AND CONDENSING THE INTERMEDIATE | MERCK & CO., INC. (US) | 2000-03-21 | — | — | US | claimed |
| WO-1999015503-A2 | PROCESS FOR MAKING DIARYL PYRIDINES USEFUL AS COX-2 INHIBITORS | MERCK & CO., INC. (US) | 1999-04-01 | — | — | WO | claimed |
| EP-0583362-A1 | OXIDATIVE SECONDARY RHODIUM RECOVERY PROCESS | EASTMAN CHEMICAL COMPANY (US) | 1994-02-23 | — | — | EP | claimed |
| WO-1992019779-A1 | OXIDATIVE SECONDARY RHODIUM RECOVERY PROCESS | EASTMAN KODAK COMPANY (US) | 1992-11-12 | — | — | WO | claimed |
| US-5100850-A | Solvent extraction with hydrogen peroxide and acetic acid to recover rhodium catalyst values from acetic anhydride production process | EASTMAN KODAK COMPANY (US) | 1992-03-31 | — | — | US | claimed |
| US-4153744-A | HYDROXYMETHYL PHOSPHORUS FLAME RETARDANT AND AMMONIA, HYDROGEN PEROXIDE-ACETIC ACID OXIDIZER | AMERICAN CYANAMID COMPANY (US) | 1979-05-08 | — | — | US | claimed |