⚠ 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 | |
|---|---|---|---|---|
| Tetrahydrofuran SCHEMBL378197 | 0.94 | ALDH1A1 (1.00) | — | |
| Tetrahydrofuran SCHEMBL479 | 0.94 | — | — | |
| SCHEMBL30466481 | 0.94 | ALDH1A1 (1.00) | — | |
| Tetrahydrofuran SCHEMBL1982618 | 0.94 | — | — | |
| SCHEMBL3455441 | 0.94 | ALDH1A1 (1.00) | — | |
| Tetrahydrofuran SCHEMBL6298732 | 0.94 | — | — | |
| SCHEMBL30432886 | 0.94 | ALDH1A1 (1.00) | — | |
| SCHEMBL9576477 | 0.94 | ALDH1A1 (1.00) | — | |
| Tetrahydrofuran SCHEMBL130914 | 0.94 | — | — | |
| Tetrahydrofuran SCHEMBL6364293 | 0.94 | ALDH1A1 (1.00) | — |
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 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110198930-A | Pyrimidine derivatives | 第一三共株式会社 | 2019-09-03 | — | — | CN | disclosed |
| CN-109678796-A | PD-1/PD-L1 micromolecular inhibitor and its preparation method and application | 上海长森药业有限公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-104592464-B | A kind of organic inorganic hybridization block copolymer and its synthetic method containing POSS and amphion structure | 厦门大学 | 2017-07-25 | — | — | CN | disclosed |
| CN-104768944-A | 2-pyridone compound | TAISHO PHARMACEUTICAL CO LTD | 2015-07-08 | — | — | CN | disclosed |
| CN-102010286-A | 9-(9-methyl-9H-fluorene-yl)anthracene and synthetic method thereof | UNIV SHANGHAI | 2011-04-13 | — | — | CN | disclosed |
| CN-101772477-A | supported iridium catalysts | UNIV NORTH CAROLINA | 2010-07-07 | — | — | CN | disclosed |
| CN-1230425-C | Optical active compound used as intermediate in preparing optical activity 2-imidazoline-5-thionone derivatives | RHONE POULENC AGROCHIMIE (FR) | 2005-12-07 | — | — | CN | disclosed |
| CN-1229336-C | Photoactive compound used as intermediate for preparing photoactive 2-imidazoline-5-ketone or 2-imdazoline-5-thio-ketone derivative | RHONE POULENC AGROCHIMIE (FR) | 2005-11-30 | — | — | CN | disclosed |
| EP-1137632-B1 | THIOUREA INHIBITORS OF HERPES VIRUSES | WYETH CORP (US) | 2004-07-28 | — | — | EP | disclosed |
| CN-1511832-A | Optical active compound used as intermediate in preparing optical activity 2-imidazoline-5-thionone derivatives | ����-���ʿ�ũҵ��ѧ��˾ | 2004-07-14 | — | — | CN | disclosed |
| WO-2000034269-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000034261-A2 | HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000034260-A2 | ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000034268-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000034238-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000034237-A2 | ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |
| WO-2000034258-A2 | HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING PHENYLENEDIAMINE GROUP | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |
| EP-1007506-A2 | COMPOSITIONS AND METHODS FOR REVERSIBLY INCREASING PERMEABILITY OF BIOMEMBRANES | D-PHARM, LTD. (IL) | 2000-06-14 | — | — | EP | disclosed |
| WO-1999002120-A2 | COMPOSITIONS AND METHODS FOR REVERSIBLY INCREASING PERMEABILITY OF BIOMEMBRANES | D-PHARM LTD. (IL) | 1999-01-21 | — | — | WO | disclosed |
| WO-1999002485-A1 | BRANCHED CHAIN FATTY ACIDS, THEIR DERIVATIVES AND USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | D-PHARM LTD. (IL) | 1999-01-21 | — | — | WO | disclosed |