⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27746288 | 0.97 | — | — | |
| Methane SCHEMBL8422391 | 0.95 | — | — | |
| SCHEMBL20049507 | 0.68 | — | — | |
| SCHEMBL20118993 | 0.68 | — | — | |
| SCHEMBL26791625 | 0.68 | — | — | |
| SCHEMBL4231498 | 0.64 | SHBG (0.38) | — | |
| SCHEMBL9247391 | 0.64 | — | — | |
| SCHEMBL9843552 | 0.64 | — | — | |
| Ammonia Solution, Strong SCHEMBL28234423 | 0.64 | CYP19A1 (0.33) | — | |
| SCHEMBL9843457 | 0.64 | — | — |
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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112159427-A | Environment-friendly energy-saving triphenyl phosphite preparation system and method | 昌和化学新材料(江苏）有限公司 | 2021-01-01 | — | — | CN | claimed |
| CN-1665801-B | Anti tubercular drug: compositions and methods | DEPT OF HEALTH AND HUMAN SERVI | 2011-05-11 | — | — | CN | claimed |
| CN-111247188-B | Polyurethane foam system | 陶氏环球技术有限责任公司 | 2022-06-07 | — | — | CN | disclosed |
| CN-112266336-A | Preparation method and application of epoxy curing agent | 深圳飞扬兴业科技有限公司 | 2021-01-26 | — | — | CN | disclosed |
| CN-112159427-A | Environment-friendly energy-saving triphenyl phosphite preparation system and method | 昌和化学新材料(江苏）有限公司 | 2021-01-01 | — | — | CN | disclosed |
| CN-105801489-B | Cycloalkyl-substituted imidazole derivatives | 第一三共株式会社 | 2019-12-10 | — | — | CN | disclosed |
| CN-103108918-A | Method for manufacturing resin for thiourethane-based optical material using universal polyisocyanate compound, resin composition, and optical material manufactured thereby | KOC SOLUTION CO LTD | 2013-05-15 | — | — | CN | disclosed |
| CN-102977309-A | Polymerizable composition for polythiourethane optical material, polythiourethane optical material obtained from the polymerizable composition, and polymerization catalyst for polythiourethane optical material | MITSUI CHEMICALS INC | 2013-03-20 | — | — | CN | disclosed |
| CN-101384636-B | Polymerizable composition for polythiourethane optical material | MITSU CHEMICALS INC | 2013-02-13 | — | — | CN | disclosed |
| CN-102803226-A | Cycloalkyl-substituted imidazole derivatives | DAIICHI SANKYO CO LTD | 2012-11-28 | — | — | CN | disclosed |
| CN-101627069-B | Polymerization catalyst for polythiourethane optical material, polymerizable composition containing the catalyst, optical material obtained from the composition, and method for producing the optical m | MITSU CHEMICALS INC | 2012-11-21 | — | — | CN | disclosed |
| CN-1596276-A | Polymerizable composition comprising novel sulfur-containing cyclic compound and resin obtained by curing the polymerizable composition | MITSUI CHEMICALS INC (JP) | 2005-03-16 | — | — | CN | disclosed |
| CN-1578802-A | Thioepoxy based polymerizable composition and method for production thereof | MITSUI CHEMICALS INC (JP) | 2005-02-09 | — | — | CN | disclosed |
| CN-1554649-A | Metabotropic glutamate receptor antagonists for treating central nervous system diseases | NPSҩ������˾ | 2004-12-15 | — | — | CN | disclosed |
| CN-1158264-C | Metabotropic glutamate receptor antagonists for the treatment of central nervous system disorders | NPSҩ������˾ | 2004-07-21 | — | — | CN | disclosed |
| CN-1285820-A | Metabotropic glutamate receptor antagonists for the treatment of central nervous system disorders | NPS PHARMA INC (US) | 2001-02-28 | — | — | CN | disclosed |
| EP-0973936-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 2000-01-26 | — | — | EP | disclosed |
| WO-1999002990-A1 | COMBINATORIAL PROCESS FOR PREPARING FUSED SUBSTITUTED PYRIMIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1999-01-21 | — | — | WO | disclosed |
| WO-1998046786-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |
| CN-1069976-A | Hexanaphthene and tetrahydropyran derivatives | HOFFMANN LA ROCHE (CH) | 1993-03-17 | — | — | CN | disclosed |