⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22166415 | 0.86 | ALDH1A1 (0.34) | — | |
| SCHEMBL22060580 | 0.84 | ALDH1A1 (0.33) | — | |
| SCHEMBL172482 | 0.82 | — | — | |
| SCHEMBL149091 | 0.80 | — | — | |
| SCHEMBL14565969 | 0.80 | — | — | |
| SCHEMBL10160834 | 0.79 | FFAR1 (0.33) | — | |
| SCHEMBL14016192 | 0.78 | — | — | |
| SCHEMBL13057485 | 0.78 | — | — | |
| SCHEMBL11321495 | 0.78 | — | — | |
| SCHEMBL13024642 | 0.78 | — | — |
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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113712885-A | Anti-dropping hair-fixing extract liquid | 优珀雅生物科技有限公司 | 2021-11-30 | — | — | CN | claimed |
| WO-2024030960-A2 | COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS | Kojin Therapeutics, Inc. (US) | 2024-02-08 | — | — | WO | disclosed |
| WO-2023196991-A1 | BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF | THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) | 2023-10-12 | — | — | WO | disclosed |
| WO-2023165168-A1 | APPLICATION OF PYRAZOLE DERIVATIVE AS β2 ADRENERGIC RECEPTOR ALLOSTERIC MODULATOR, ANTAGONIST AND AGONIST | 常州大学 | 2023-09-07 | — | — | WO | disclosed |
| CN-115461327-A | Spiro urea derivatives | 爱杜西亚药品有限公司 | 2022-12-09 | — | — | CN | disclosed |
| CN-114712259-A | Anti-hair loss and hair-fixing composition, preparation method and application product thereof | 诺斯贝尔化妆品股份有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-113712885-A | Anti-dropping hair-fixing extract liquid | 优珀雅生物科技有限公司 | 2021-11-30 | — | — | CN | disclosed |
| CN-113712885-A | Anti-dropping hair-fixing extract liquid | 优珀雅生物科技有限公司 | 2021-11-30 | — | — | CN | disclosed |
| EP-2652108-B1 | DILUTABLE CONCENTRATED CLEANING COMPOSITION | COLGATE PALMOLIVE CO (US) | 2019-07-24 | — | — | EP | disclosed |
| WO-2019065283-A1 | PYRIDAZINONE COMPOUND OR SALT THEREOF AND HERBICIDE CONTAINING SAME | 石原産業株式会社 | 2019-04-04 | — | — | WO | disclosed |
| EP-2083014-A2 | Inhibitors of interleukin-1ß converting enzyme | Vertex Pharmceuticals Incorporated (US) | 2009-07-29 | — | — | EP | disclosed |
| US-7491494-B2 | Evolving new molecular function | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2009-02-17 | — | — | US | disclosed |
| EP-1343503-B1 | HETEROARYL UREA NEUROPEPTIDE Y Y5 RECEPTOR ANTAGONISTS | SCHERING CORP (US) | 2008-11-12 | — | — | EP | disclosed |
| US-20070043208-A1 | Crystal structure of erythrocyte binding domain of EBA-175 | NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR | 2007-02-22 | — | — | US | disclosed |
| EP-1392644-A1 | CINNAMIDE DERIVATIVES AS KCNQ POTASSIUM CHANNEL MODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002096858-A1 | CINNAMIDE DERIVATIVES AS KCNQ POTASSIUM CHANNEL MODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-12-05 | — | — | WO | disclosed |
| EP-0639554-A1 | Process for the preparation of propargyl ethers | BAYER AG (DE) | 1995-02-22 | — | — | EP | disclosed |
| US-5250742-A | Process for the production of propargyl ethers and new propargyl ethers | BAYER AKTIENGESELLSCHAFT (DE) | 1993-10-05 | — | — | US | disclosed |
| EP-0523475-A1 | Propargyl ethers and process for their preparation | BAYER AG (DE) | 1993-01-20 | — | — | EP | disclosed |
| EP-0114389-A2 | Substituted arylglyoxal derivatives | AMERICAN CYANAMID COMPANY (US) | 1984-08-01 | — | — | EP | disclosed |