Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Ether. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Ether SCHEMBL10962604 | 0.96 | ALDH1A1 (0.50) | — | |
| Ether SCHEMBL5597265 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL6581224 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL27267758 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL9058622 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL9688867 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL2801167 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL5693230 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL9321955 | 0.96 | ALDH1A1 (0.56) | — | |
| Ether SCHEMBL1797 | 0.96 | — | — |
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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108499544-B | Preparation method of polystyrene microsphere cellulose-based heavy metal adsorbent | 广西大学 | 2020-12-01 | — | — | CN | claimed |
| CN-117470746-A | Rapid visual inspection method for sun-screening effect of sun-screening product and application thereof | 广州雅纯化妆品制造有限公司 | 2024-01-30 | — | — | CN | disclosed |
| EP-2858989-B9 | AMORPHOUS FORM OF AN AKT INHIBITING PYRIMIDINYL-CYCLOPENTANE COMPOUND, COMPOSITIONS AND METHODS THEREOF | GENENTECH INC (US) | 2021-04-14 | — | — | EP | disclosed |
| CN-108499544-B | Preparation method of polystyrene microsphere cellulose-based heavy metal adsorbent | 广西大学 | 2020-12-01 | — | — | CN | disclosed |
| EP-3719014-A1 | SOLID FORMS OF AN AKT INHIBITING PYRIMIDINYL-CYCLOPENTANE COMPOUND, COMPOSITIONS AND METHODS THEREOF | Genentech, Inc. (US) | 2020-10-07 | — | — | EP | disclosed |
| EP-2858989-B1 | AMORPHOUS FORM OF AN AKT INHIBITING PYRIMIDINYL-CYCLOPENTANE COMPOUND, COMPOSITIONS AND METHODS THEREOF | GENENTECH INC (US) | 2020-05-06 | — | — | EP | disclosed |
| US-9932443-B2 | Peptide-based materials | UNIVERSITY OF SOUTH FLORIDA (US) | 2018-04-03 | — | — | US | disclosed |
| US-9505725-B2 | Crystalline and mesomorphous forms of an AKT inhibiting pyrimidinyl-cyclopentane compound, compositions and methods thereof | GENENTECH, INC. (US) | 2016-11-29 | — | — | US | disclosed |
| WO-2016091387-A1 | SALTS OF IDELALISIB | RATIOPHARM GMBH (DE) | 2016-06-16 | — | — | WO | disclosed |
| EP-3031808-A1 | Salt of idelalisib | ratiopharm GmbH (DE) | 2016-06-15 | — | — | EP | disclosed |
| US-5358949-A | Carbostyril derivatives and salts thereof and anti-arrhythmic agents containing the carbostyril derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-10-25 | — | — | US | disclosed |
| US-5306720-A | Treatment of cerebrovascular disorders | EISAI CO., LTD. (JP) | 1994-04-26 | — | — | US | disclosed |
| EP-0229391-B1 | PIPERIDINE DERIVATE, ITS USE AND PHARMACEUTICAL COMPOSITION CONTAINING IT | Eisai Co., Ltd. (JP) | 1992-07-29 | — | — | EP | disclosed |
| US-5118684-A | For cardiovascular disorder | EISAI CO., LTD. (JP) | 1992-06-02 | — | — | US | disclosed |
| US-5039681-A | Cognition activators, brain disorders, psychology | EISAI CO., LTD. (JP) | 1991-08-13 | — | — | US | disclosed |
| US-4942169-A | COGNITION ACTIVATORS, ANTICHOLINESTERASE | EISAI CO., LTD. (JP) | 1990-07-17 | — | — | US | disclosed |
| US-4882330-A | 1-aryloxy-4-[((4-aryl)-1-piperazinyl]-2-butanols useful as antiallergy agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-11-21 | — | — | US | disclosed |
| US-4849431-A | ANTICHOLINESTERASE ACTIVITY | EISAI CO., LTD. (JP) | 1989-07-18 | — | — | US | disclosed |
| US-4806555-A | CARDIAC ARRHYTHMIA INHIBITOR | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-02-21 | — | — | US | disclosed |
| EP-0269383-A2 | 1-Aryloxy-4-[(4-aryl)-1-piperazinyl]-2-butanols useful as antiallergy agents | A.H. ROBINS COMPANY, INCORPORATED (US) | 1988-06-01 | — | — | EP | disclosed |