⚠ 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL17977991 | 0.97 | TSHR (1.00) | — | |
| SCHEMBL3008675 | 0.97 | — | — | |
| SCHEMBL4454 | 0.97 | — | — | |
| SCHEMBL19298582 | 0.97 | TSHR (1.00) | — | |
| Dimethylamine SCHEMBL7642350 | 0.93 | TSHR (0.93) | — | |
| Hydrochloric Acid SCHEMBL2637990 | 0.93 | — | — | |
| SCHEMBL357105 | 0.93 | — | — | |
| Ammonia Solution, Strong SCHEMBL7932140 | 0.93 | — | — | |
| Iodide SCHEMBL22092509 | 0.93 | — | — | |
| Water SCHEMBL486305 | 0.93 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3725784-B1 | A PROCESS FOR THE CHAIN GROWTH POLYMERIZATION OF FUNCTIONALIZED ALPHA-ANGELICA LACTONE MONOMERS | HENKEL AG & CO KGAA (DE) | 2022-06-29 | — | — | EP | disclosed |
| US-20220033370-A1 | FUNCTIONALIZED A- ANGELICA LACTONE MONOMERS AND POLYMERS OBTAINED THEREFROM | HENKEL AG & CO. KGAA (DE) | 2022-02-03 | — | — | US | disclosed |
| CN-109251216-B | Application of p-methylanilino lithium in catalysis of imine and borane hydroboration reaction | 南通纺织丝绸产业技术研究院 | 2020-12-18 | — | — | CN | disclosed |
| WO-2020212041-A1 | FUNCTIONALIZED α-ANGELICA LACTONE MONOMERS AND POLYMERS OBTAINED THEREFROM | HENKEL AG & CO. KGAA (DE) | 2020-10-22 | — | — | WO | disclosed |
| EP-3725784-A1 | FUNCTIONALIZED ALPHA-ANGELICA LACTONE MONOMERS AND POLYMERS OBTAINED THEREFROM | Henkel AG & Co. KGaA (DE) | 2020-10-21 | — | — | EP | disclosed |
| CN-108554446-B | Application of lithium p-methylanilino in catalyzing aldehyde and borane hydroboration reaction | 苏州大学 | 2020-05-05 | — | — | CN | disclosed |
| CN-104030995-A | Hole-transporting material with main body big ring and multiple-lateral branch triphenylamine built by triphenylamine | KONG QINGGANG | 2014-09-10 | — | — | CN | disclosed |
| CN-104016934-A | Macrocyclic compound coupled with triphenylamine from both sides of fluorenone | TAIZHOU JIAXIN NEW MATERIALS CO LTD | 2014-09-03 | — | — | CN | disclosed |
| CN-102958892-A | Method for preparing chemical compounds of interest by aromatic nucleophilic substitution | CENTRE NAT RECH SCIENT | 2013-03-06 | — | — | CN | disclosed |
| CN-101687012-A | New cyclic peptide compounds | ASTELLAS PHARMA INC | 2010-03-31 | — | — | CN | disclosed |
| US-6350834-B1 | CATALYTIC ADDITION POLYMERIZATION | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-26 | — | — | US | disclosed |
| CN-1075495-C | Process for producing 2-('omega'-alkoxycarbonylalkanoyl)-4-butanolide and long-chain 'omega'-hydroxy carboxylic acid | TORAY INDUSTRIES (JP) | 2001-11-28 | — | — | CN | disclosed |
| CN-1165515-A | Process for producing 2-('omega'-alkoxycarbonylalkanoyl)-4-butanolide and long-chain 'omega'-hydroxy carboxylic acid | TORAY INDUSTRIES (JP) | 1997-11-19 | — | — | CN | disclosed |