⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1782311 | 0.86 | — | — | |
| SCHEMBL8676224 | 0.78 | — | — | |
| SCHEMBL11746244 | 0.75 | — | — | |
| SCHEMBL12994342 | 0.74 | — | — | |
| SCHEMBL28626105 | 0.74 | — | — | |
| SCHEMBL19371909 | 0.74 | TRPA1 (0.31) | — | |
| SCHEMBL19995244 | 0.74 | — | — | |
| SCHEMBL4866014 | 0.69 | CYP19A1 (0.37) | — | |
| SCHEMBL16691803 | 0.69 | — | — | |
| SCHEMBL4858488 | 0.69 | CYP19A1 (0.37) | — |
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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118084828-A | Method for preparing epoxy compound by catalytic oxidation of olefin | 中国科学院大连化学物理研究所 | 2024-05-28 | — | — | CN | claimed |
| CN-114317624-A | Method for synthesizing poly- (R) -5-methyl-epsilon-caprolactone by three-enzyme catalysis by using microchannel reaction device | 南京工业大学 | 2022-04-12 | — | — | CN | claimed |
| CN-109371749-A | A kind of light off-type force silicone oil of dust sticky paper and preparation method thereof | 江苏创客新材料科技有限公司 | 2019-02-22 | — | — | CN | claimed |
| CN-104693016-B | Method for preparing 4-methylbenzaldehyde from isoprene and acrolein | 中国科学院大连化学物理研究所 | 2017-04-12 | — | — | CN | claimed |
| CN-103319521-A | Cyclic siloxane compositions for the release of active ingredients | GEN ELECTRIC | 2013-09-25 | — | — | CN | claimed |
| CN-118084828-A | Method for preparing epoxy compound by catalytic oxidation of olefin | 中国科学院大连化学物理研究所 | 2024-05-28 | — | — | CN | disclosed |
| CN-114317624-B | Method for synthesizing poly- (R) -5-methyl-epsilon-caprolactone by utilizing micro-channel reaction device through three-enzyme catalysis | 南京工业大学 | 2024-05-07 | — | — | CN | disclosed |
| CN-111939975-B | Bifunctional molecular sieve catalyst for directly preparing 1,2-diol by catalyzing olefin and application thereof | 南开大学 | 2023-03-28 | — | — | CN | disclosed |
| CN-114317624-A | Method for synthesizing poly- (R) -5-methyl-epsilon-caprolactone by three-enzyme catalysis by using microchannel reaction device | 南京工业大学 | 2022-04-12 | — | — | CN | disclosed |
| CN-114317624-A | Method for synthesizing poly- (R) -5-methyl-epsilon-caprolactone by three-enzyme catalysis by using microchannel reaction device | 南京工业大学 | 2022-04-12 | — | — | CN | disclosed |
| CN-114057697-A | Preparation method of tipiracil intermediate | 鲁南制药集团股份有限公司 | 2022-02-18 | — | — | CN | disclosed |
| CN-111939975-A | Bifunctional molecular sieve catalyst for directly preparing 1, 2-diol by catalyzing olefin and application thereof | 南开大学 | 2020-11-17 | — | — | CN | disclosed |
| US-8298965-B2 | Volatile precursors for deposition of C-linked SiCOH dielectrics | AMERICAN AIR LIQUIDE, INC. (US) | 2012-10-30 | — | — | US | disclosed |
| US-20110117147-A1 | COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2011-05-19 | — | — | US | disclosed |
| US-20100052115-A1 | Volatile Precursors for Deposition of C-Linked SiCOH Dielectrics | AMERICAN AIR LIQUIDE, INC. (US) | 2010-03-04 | — | — | US | disclosed |
| WO-2009123355-A2 | COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2009-10-08 | — | — | WO | disclosed |
| CN-101208082-A | Niacin receptor agonists, compositions containing such compounds and methods of treatment | MERCK & CO INC (US) | 2008-06-25 | — | — | CN | disclosed |
| CN-1893910-A | Cyclic siloxane compositions for active ingredient release | GEN ELECTRIC (US) | 2007-01-10 | — | — | CN | disclosed |
| CN-1832744-A | Treatment for alzheimer's disease and related conditions | MERCK SHARP & DOHME (GB) | 2006-09-13 | — | — | CN | disclosed |
| US-20030211963-A1 | Laundry and cleaning compositions | THE PROCTER & GAMBLE COMPANY | 2003-11-13 | — | — | US | disclosed |