⚠ 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 | |
|---|---|---|---|---|
| Ethylene SCHEMBL78279 | 0.95 | — | — | |
| SCHEMBL161507 | 0.69 | — | — | |
| SCHEMBL5405236 | 0.67 | — | — | |
| SCHEMBL12786389 | 0.65 | — | — | |
| SCHEMBL10455224 | 0.65 | — | — | |
| SCHEMBL112009 | 0.65 | — | — | |
| SCHEMBL677601 | 0.65 | — | — | |
| SCHEMBL6738847 | 0.65 | TYR (0.39) | — | |
| SCHEMBL12135406 | 0.65 | — | — | |
| SCHEMBL14594115 | 0.63 | ALDH1A1 (0.32) | — |
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 93 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1673321-B9 | METHOD OF PREPARING FULVENE COMPOUNDS AND METHOD OF PREPARING ANSA-METALLOCENE COMPOUNDS USING THE COMPOUNDS | LG CHEMICAL LTD (KR) | 2015-04-22 | — | — | EP | claimed |
| EP-1673321-B1 | METHOD OF PREPARING FULVENE COMPOUNDS AND METHOD OF PREPARING ANSA-METALLOCENE COMPOUNDS USING THE COMPOUNDS | LG CHEMICAL LTD (KR) | 2014-09-17 | — | — | EP | claimed |
| US-7166731-B2 | Method of preparing fulvene compounds and method of preparing ansa-metallocene compounds using the compounds | LG CHEM. LTD. (KR) | 2007-01-23 | — | — | US | claimed |
| US-20050080296-A1 | Method of preparing fulvene compounds and method of preparing ansa-metallocene compounds using the compounds | LG CHEM. LTD. (KR) | 2005-04-14 | — | — | US | claimed |
| US-9643919-B2 | Cycloalkyl-dione derivatives and methods of their use | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2017-05-09 | — | — | US | disclosed |
| US-20160168188-A1 | SYNTHESIS OF ENT-PROGESTERONE AND INTERMEDIATES THEREOF | PREVACUS, INC. | 2016-06-16 | — | — | US | disclosed |
| US-20160168188-A1 | SYNTHESIS OF ENT-PROGESTERONE AND INTERMEDIATES THEREOF | PREVACUS, INC. | 2016-06-16 | — | — | US | disclosed |
| US-20160108081-A1 | SYNTHESIS OF ENT-PROGESTERONE AND INTERMEDIATES THEREOF | PREVACUS INC (US) | 2016-04-21 | — | — | US | disclosed |
| US-20160108081-A1 | SYNTHESIS OF ENT-PROGESTERONE AND INTERMEDIATES THEREOF | PREVACUS INC (US) | 2016-04-21 | — | — | US | disclosed |
| EP-1532181-B1 | FULVENE AND PREPARATION THEREOF | LG CHEMICAL LTD (KR) | 2016-03-16 | — | — | EP | disclosed |
| US-20160031805-A1 | CYCLOALKYL-DIONE DERIVATIVES AND METHODS OF THEIR USE | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2016-02-04 | — | — | US | disclosed |
| US-20160016988-A1 | SYNTHESIS OF ENT-PROGESTERONE AND INTERMEDIATES THEREOF | UNIV FLORIDA STATE RES FOUND (US) | 2016-01-21 | — | — | US | disclosed |
| EP-1532181-A1 | FULVENE, METALLOCENE CATALYSTS AND PREPARATION METHOD THEREOF, AND PREPARATION OF POLYOLEFINES COPOLYMER USING THE SAME | LG Chem, Ltd. (KR) | 2005-05-25 | — | — | EP | disclosed |
| US-20050080296-A1 | Method of preparing fulvene compounds and method of preparing ansa-metallocene compounds using the compounds | LG CHEM. LTD. (KR) | 2005-04-14 | — | — | US | disclosed |
| US-20050075366-A1 | 4-(2-Methyl-5,6,7,8-tetrahydro-quinolin-7-ylmethyl)-1,3-dihydro-imidazole-2-thione as specific alpha2B agonist and methods of using the same | ALLERGAN, INC. | 2005-04-07 | — | — | US | disclosed |
| EP-1507767-A1 | 4-SUBSTITUTED IMIDAZOLE-2-THIONES AND IMIDAZOL-2-ONES AS AGONISTS OF THE ALPHA-2B AND ALPHA-2C ADRENERGIC RECEPTORS | Allergan, Inc. (US) | 2005-02-23 | — | — | EP | disclosed |
| US-20050004385-A1 | Fulvene, metallocene catalysts and preparation method thereof, and preparation of polyolefines copolymer using the same | LG CHEM, LTD. (KR) | 2005-01-06 | — | — | US | disclosed |
| US-20040220402-A1 | 4-(substituted cycloalkylmethyl) imidazole-2-thiones, 4-(substituted cycloalkenylmethyl) imidazole-2-thiones, 4-(substituted cycloalkylmethyl) imidazol-2-ones and 4-(substituted cycloalkenylmethyl) imidazol-2-ones and related compounds | ALLERGAN, INC. | 2004-11-04 | — | — | US | disclosed |
| WO-2004020481-A1 | FULVENE, METALLOCENE CATALYSTS AND PREPARATION METHOD THEREOF, AND PREPARATION OF POLYOLEFINES COPOLYMER USING THE SAME | LG CHEM, LTD. (KR) | 2004-03-11 | — | — | WO | disclosed |
| WO-2003099795-A1 | 4-SUBSTITUTED IMIDAZOLE-2-THIONES AND IMIDAZOL-2-ONES AS AGONISTS OF THE ALPHA-2B AND ALPHA-2C ADRENERGIC RECEPTORS | ALLERGAN, INC. (US) | 2003-12-04 | — | — | WO | disclosed |