⚠ 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 | |
|---|---|---|---|---|
| Tridecanal SCHEMBL4603233 | 0.97 | TSHR (0.60) | — | |
| Nonanal SCHEMBL8832383 | 0.97 | TSHR (0.60) | — | |
| Octanal SCHEMBL15990705 | 0.97 | — | — | |
| Heptanal SCHEMBL17181651 | 0.97 | — | — | |
| SCHEMBL4601985 | 0.97 | TSHR (0.60) | — | |
| Palmitaldehyde SCHEMBL4602579 | 0.97 | TSHR (0.60) | — | |
| Pentanal SCHEMBL2818314 | 0.90 | — | — | |
| SCHEMBL28821 | 0.75 | — | — | |
| SCHEMBL28822 | 0.75 | — | — | |
| Butanal SCHEMBL483706 | 0.74 | — | — |
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 1111 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110143938-A | α-exo- methylene lactone class compound and its application | 暨南大学 | 2019-08-20 | — | — | CN | claimed |
| CN-110028504-A | The preparation method and applications of phenanthroline and its cobalt complex that 2,9- diaryl replaces | 南开大学 | 2019-07-19 | — | — | CN | claimed |
| CN-108997321-A | A kind of chiral amino diether compounds and its preparation method and application | 暨南大学 | 2018-12-14 | — | — | CN | claimed |
| CN-107586296-A | The preparation method and applications of the phenanthroline and its iron complex of the substitution of 2,9 diaryl | 南开大学 | 2018-01-16 | — | — | CN | claimed |
| CN-106518931-A | Novel iridium complex of spirophosphine-carboxylic acid, preparation method and application thereof | 南开大学 | 2017-03-22 | — | — | CN | claimed |
| US-20160009703-A1 | BENZO FIVE-MEMBERED NITROGEN HETEROCYCLIC PIPERIDINE OR PIPERAZINE DERIVATIVES AND PREPARATION METHODS AND PHARMACEUTICAL COMPOSITIONS THEREOF | LIAONING EMMY BIOLOGICAL PHARMACEUTICAL CO., LTD (CN) | 2016-01-14 | — | — | US | claimed |
| US-20150297586-A1 | USE OF BENZO FIVE-MEMBERED NITROGEN HETEROCYCLIC PIPERAZINE OR PIPERIDINE DERIVATIVES | Liaoning Emmy Biological Pharmaceutical Co., Ltd. (CN) | 2015-10-22 | — | — | US | claimed |
| CN-104755510-A | Ziegler-Natta catalyst systems comprising a 1,2-phenylenedioate as internal donor and process for preparing the same | INDIAN OIL CORP LTD | 2015-07-01 | — | — | CN | claimed |
| CN-103421133-A | Rare-earth metal catalysis system for catalyzing high-stereoregularity polymerization of alpha-olefin | UNIV DALIAN TECH | 2013-12-04 | — | — | CN | claimed |
| CN-101906093-B | Benzo five-membered unsaturated heterocycle compound and preparation method thereof | INST MEDICINAL BIOTECHNOLOGY | 2013-07-10 | — | — | CN | claimed |
| CN-101412738-A | Novel chiral iron complex, and preparation and use thereof | ZHEJIANG JIUZHOU PHARMACEUTICA (CN) | 2009-04-22 | — | — | CN | claimed |
| CN-101094858-A | Method for producing functionalized silanes and siloxanes | NOUVEAW EXPORTS PRIVATE LTD (IN) | 2007-12-26 | — | — | CN | claimed |
| CN-101028263-A | Use of substituted isoandrographolide derivative | CHINA PHARMACEUTICS UNIV (CN) | 2007-09-05 | — | — | CN | claimed |
| CN-101012211-A | Substituted andrographolide derivative, preparing method and pharmaceutical compound thereof | UNIV CHINA PHARMA (CN) | 2007-08-08 | — | — | CN | claimed |
| CN-1865214-A | Method for producing aromatic carboxylic acid using nitrogen oxide as catalytic additive | SINOPEC YANGTZE PETROCHEMICAL (CN) | 2006-11-22 | — | — | CN | claimed |
| CN-1250211-C | Remediesor preventives containing cyclopentenone compounds as the active ingredient | TAKARA SHUZO CO (JP) | 2006-04-12 | — | — | CN | claimed |
| CN-1105157-C | Catalyst for low temp. cure of blocked isocyanates | ATOCHEM NORTH AMERICA ELF (US) | 2003-04-09 | — | — | CN | claimed |
| CN-1322707-A | Producing process for triazole derivant | KANEGAFUCHI CHEMICAL IND (JP) | 2001-11-21 | — | — | CN | claimed |
| CN-1167789-A | Catalyst for low temp. cure of blocked isocyanates | ATOCHEM NORTH AMERICA ELF (US) | 1997-12-17 | — | — | CN | claimed |
| CN-1126987-A | Process for producing triazole derivative | KANEGAFUCHI CHEMICAL IND (JP) | 1996-07-17 | — | — | CN | claimed |