⚠ 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 SCHEMBL6646249 | 0.97 | — | — | |
| Methylene Chloride SCHEMBL28225999 | 0.94 | TSHR (0.41) | — | |
| Pivalate SCHEMBL2718295 | 0.89 | TSHR (0.40) | — | |
| Bicarbonate SCHEMBL10784005 | 0.89 | CA4 (0.38) | — | |
| Bicarbonate SCHEMBL10784008 | 0.89 | CA4 (0.38) | — | |
| SCHEMBL15528391 | 0.87 | TSHR (0.70) | — | |
| SCHEMBL665258 | 0.80 | TSHR (0.45) | — | |
| SCHEMBL9062153 | 0.78 | — | — | |
| SCHEMBL13343045 | 0.77 | TSHR (0.38) | — | |
| SCHEMBL25246442 | 0.75 | TSHR (0.41) | — |
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 2932 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 |
|---|---|---|---|---|---|---|---|
| WO-2025083736-A1 | NOVEL PROCESS FOR THE PREPARATION OF PIRTOBRUTINIB AND ITS INTERMEDIATES THEREOF | MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) | 2025-04-24 | — | — | WO | claimed |
| WO-2024094637-A1 | PROCESS FOR THE PREPARATION OF CYCLIC KETONES | ARXADA AG (CH) | 2024-05-10 | — | — | WO | claimed |
| CN-116283948-A | Synthesis method of ezetimibe intermediate | 江苏阿尔法药业股份有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-109678852-B | 6-oxo-hexahydropyrimidine derivative, preparation method and pharmaceutical application thereof | 南京中医药大学 | 2022-04-19 | — | — | CN | claimed |
| CN-110643032-B | Eight-arm polyethylene glycol, preparation method, functionalized derivative and modified biologically-relevant substance | 厦门赛诺邦格生物科技股份有限公司 | 2022-01-28 | — | — | CN | claimed |
| EP-3250211-B1 | NOVEL PROCESS FOR PREPARATION OF GLUCOCORTICOID STEROIDS | CORAL DRUGS PVT LTD (IN) | 2021-12-22 | — | — | EP | claimed |
| CN-110643032-A | Eight-arm polyethylene glycol, preparation method, functionalized derivative and modified biologically-relevant substance | 厦门赛诺邦格生物科技股份有限公司 | 2020-01-03 | — | — | CN | claimed |
| CN-106967213-B | Eight-arm polyethylene glycol, preparation method, functionalized derivative and modified biologically-relevant substance | 厦门赛诺邦格生物科技股份有限公司 | 2019-11-05 | — | — | CN | claimed |
| CN-109678852-A | 6- oxo hexahydropyrimidine derivative, preparation method and pharmacy application | 南京中医药大学 | 2019-04-26 | — | — | CN | claimed |
| US-10233210-B2 | Process for preparation of glucocorticoid steroids | CORAL DRUGS PVT. LTD. (IN) | 2019-03-19 | — | — | US | claimed |
| CN-101279908-A | Preparation of 3,3-dimethyl butyryl chloride | UNIV XIAMEN (CN) | 2008-10-08 | — | — | CN | claimed |
| US-7358381-B2 | Racemoselective preparation of bridged metallocene complexes having unsubstituted or 2-substituted indenyl ligands | BASELL POLYOLEFINE GMBH (DE) | 2008-04-15 | — | — | US | claimed |
| EP-1554297-B1 | RACEMOSELECTIVE SYNTHESIS OF RAC-DIORGANOSILYLBIS(2-METHYLBENZO¬E|INDEYL) ZIRCONIUM COMPONDS | BASELL POLYOLEFINE GMBH (DE) | 2006-07-12 | — | — | EP | claimed |
| CN-1778789-A | Production of 3,3-dimethyl-butyrylchlorine | WANG JUNHUA (CN) | 2006-05-31 | — | — | CN | claimed |
| US-20060111527-A1 | Racemoselective preparation of bridged metallocene complexes having unsubstituted or 2-substituted indenyl ligands | EQUISTAR CHEMICALS, LP | 2006-05-25 | — | — | US | claimed |
| EP-1556417-A2 | RACEMOSELECTIVE PREPARATION OF BRIDGED METALLOCENE COMPLEXES HAVING UNSUBSTITUTED OR 2-SUBSTITUTED INDENYL LIGANDS | Basell Polyolefine GmbH (DE) | 2005-07-27 | — | — | EP | claimed |
| EP-1554297-A1 | RACEMOSELECTIVE SYNTHESIS OF RAC-DIORGANOSILYLBIS(2-METHYLBENZO[E]INDEYL) ZIRCONIUM COMPONDS | Basell Polyolefine GmbH (DE) | 2005-07-20 | — | — | EP | claimed |
| WO-2004037834-A2 | RACEMOSELECTIVE PREPARATION OF BRIDGED METALLOCENE COMPLEXES HAVING UNSUBSTITUTED OR 2-SUBSTITUTED INDENYL LIGANDS | BASELL POLYOLEFINE GMBH (DE) | 2004-05-06 | — | — | WO | claimed |
| WO-2004037840-A1 | RACEMOSELECTIVE SYNTHESIS OF RAC-DIORGANOSILYLBIS(2-METHYLBENZO[E]INDEYL) ZIRCONIUM COMPONDS | BASELL POLYOLEFINE GMBH (DE) | 2004-05-06 | — | — | WO | claimed |
| US-4013649-A | METHOD OF MAKING 4-AMINO-6-T-BUTYL-3-MERCAPTO-1,2,4-TRIAZIN-5-ONE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-03-22 | — | — | US | claimed |