⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29635862 | 1.00 | — | — | |
| SCHEMBL28061440 | 1.00 | CA1 (0.63) | — | |
| SCHEMBL3907382 | 0.97 | CA1 (0.60) | — | |
| SCHEMBL2973304 | 0.97 | CA1 (0.60) | — | |
| Hydrogen Sulfide SCHEMBL28185953 | 0.97 | CA1 (0.60) | — | |
| Phosphine SCHEMBL17580357 | 0.97 | CA1 (0.60) | — | |
| Water SCHEMBL28959107 | 0.97 | CA1 (0.60) | — | |
| Ammonia Solution, Strong SCHEMBL4261840 | 0.97 | CA1 (0.60) | — | |
| SCHEMBL972033 | 0.97 | CA1 (0.60) | — | |
| Nitrogen SCHEMBL28278309 | 0.95 | CA1 (0.57) | — |
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
Appears in 2425 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118459305-A | Method for co-producing bio-based paraxylene and toluene | 北京化工大学 | 2024-08-09 | — | — | CN | claimed |
| CN-117945859-B | Process synthesis of o-fluorophenol | 内蒙古源宏精细化工有限公司 | 2024-06-18 | — | — | CN | claimed |
| US-20240138408-A1 | COMPOSITION COMPRISING BENZYLAMINE ACARICIDE AND USE THEREOF | SHANGDONG KANGIAO BIO-TECHNOLOGY CO., LTD (CN) | 2024-05-02 | — | — | US | claimed |
| CN-117945859-A | Process synthesis of o-fluorophenol | 内蒙古源宏精细化工有限公司 | 2024-04-30 | — | — | CN | claimed |
| CN-111278837-B | Hydrocarbon-soluble halogen and thiol/magnesium exchange reagent | 雅宝德国有限责任公司 | 2024-04-09 | — | — | CN | claimed |
| WO-2023061415-A1 | THIADIAZOLYL DERIVATIVES, COMPOSITIONS AND USES THEREOF | DANATLAS PHARMACEUTICALS CO., LTD. (CN) | 2023-04-20 | — | — | WO | claimed |
| CN-115651170-A | Preparation of heptazine-based polymer and application of heptazine-based polymer in photocatalytic oxidation of thioether | 福州大学 | 2023-01-31 | — | — | CN | claimed |
| CN-115521299-A | Preparation method of lubabylon intermediate | 天和药业股份有限公司 | 2022-12-27 | — | — | CN | claimed |
| CN-115368218-A | Method for preparing 4-diaryl methyl substituted phenol compound | 湖南理工学院 | 2022-11-22 | — | — | CN | claimed |
| WO-2022166842-A1 | COMPOSITION COMPRISING BENZYLAMINE ACARICIDE AND USE THEREOF | 山东康乔生物科技有限公司 | 2022-08-11 | — | — | WO | claimed |
| EP-0140783-B1 | PROCESS FOR THE PREPARATION OF META-SUBSTITUTED ANILINES | RHONE-POULENC CHIMIE (FR) | 1986-11-26 | — | — | EP | claimed |
| US-4473713-A | Hydrolysis of aryl-aliphatic ethers | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-09-25 | — | — | US | claimed |
| EP-0006212-B1 | SYSTEM OF PULVERISATION IN THE FORM OF AN AEROSOL | Airwick AG (CH) | 1981-08-05 | — | — | EP | claimed |
| US-4207266-A | CARBON TETRALIDE, HYDROGEN FLUORIDE, LEWIS ACID AD AROMATIC HYDROCARBON | ROHM AND HAAS COMPANY (US) | 1980-06-10 | — | — | US | claimed |
| EP-0006212-A1 | System of pulverisation in the form of an aerosol | Airwick AG (CH) | 1980-01-09 | — | — | EP | claimed |
| US-4135045-A | PROCESS FOR POLYMERIZATION OF OLEFINS AND CATALYST COMPOSITION THEREFOR | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1979-01-16 | — | — | US | claimed |
| US-4127504-A | TITANIUM-ALUMINUM CONTAINING | TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) | 1978-11-28 | — | — | US | claimed |
| US-4127505-A | TITANIUM-ALUMINUM CONTAINING | TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) | 1978-11-28 | — | — | US | claimed |
| US-4117014-A | PROSTAGLANDIN DERIVATIVES | ABBOTT LABORATORIES (US) | 1978-09-26 | — | — | US | claimed |
| US-4048415-A | TITANIUM-ALUMINUM COORDINATION CATALYSTS | MITSUI PETROCHEMICAL INDUSTRIES LTD. (JA) | 1977-09-13 | — | — | US | claimed |