⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL811559 | 0.97 | TSHR (0.72) | — | |
| Iodomethane SCHEMBL8981694 | 0.95 | TSHR (0.68) | — | |
| Alcohol SCHEMBL7128451 | 0.92 | TSHR (0.65) | — | |
| SCHEMBL16972751 | 0.90 | TSHR (0.62) | — | |
| Ether SCHEMBL12981250 | 0.88 | TSHR (0.59) | — | |
| Hexane SCHEMBL4632599 | 0.88 | TSHR (0.59) | — | |
| Dimethyl Succinate SCHEMBL28054469 | 0.87 | TSHR (1.00) | — | |
| Dimethyl Succinate SCHEMBL10213 | 0.87 | TSHR (1.00) | — | |
| Dimethyl Succinate SCHEMBL7902252 | 0.86 | TSHR (0.72) | — | |
| Dimethyl Succinate SCHEMBL28197319 | 0.85 | TSHR (0.81) | — |
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 2014 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 |
|---|---|---|---|---|---|---|---|
| US-12637401-B2 | Separation process for the production of C5 or C6 alkanediol | JOHNSON MATTHEY DAVY TECHNOLOGIES LIMITED (GB) | 2026-05-26 | — | — | US | claimed |
| CN-119979212-B | Method and system for preparing liquid fuel by catalyzing residual sludge mixed polysaccharide through temperature-sensitive phase change acid | 西安建筑科技大学 | 2026-02-27 | — | — | CN | claimed |
| US-20250206869-A1 | CROSSLINKABLE AQUEOUS COATING COMPOSITION | Bona AB (SE) | 2025-06-26 | — | — | US | claimed |
| CN-120040391-A | Method for preparing gamma-valerolactone by mild and efficient catalysis of levulinic acid and hydrogenation of levulinic acid ester | 陕西师范大学 | 2025-05-27 | — | — | CN | claimed |
| WO-2025093527-A1 | AN EMULSIFIABLE CONCENTRATE HAVING AN AMIDE/ESTER/CO-SOLVENT SOLVENT SYSTEM | BASF SE (DE) | 2025-05-08 | — | — | WO | claimed |
| CN-119751283-A | Method for preparing 5-aminolevulinic acid step by step under assistance of ultrasound | 昆明理工大学 | 2025-04-04 | — | — | CN | claimed |
| CN-119661299-A | Method for synthesizing cyclopentadiene from levulinic acid and derivative thereof | 中国科学院大连化学物理研究所 | 2025-03-21 | — | — | CN | claimed |
| CN-119549177-A | Metal-free catalyst, preparation method and application thereof in preparation of benzyl alcohol by transfer hydrogenation of biomass-based benzaldehyde | 淮阴师范学院 | 2025-03-04 | — | — | CN | claimed |
| CN-118006576-B | Amine dehydrogenase mutant and method for synthesizing non-alpha-amino acid | 江南大学 | 2025-02-14 | — | — | CN | claimed |
| US-20250040543-A1 | Preservative Composition | Arxada Switzerland AG (CH) | 2025-02-06 | — | — | US | claimed |
| CN-1411486-A | Preparation of functional polymeric surface | COMMW SCIENT IND RES ORG (AU) | 2003-04-16 | — | — | CN | claimed |
| EP-1292555-A2 | CATALYTIC HYDROGENATION OF KETONES AND ALDEHYDES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2003-03-19 | — | — | EP | claimed |
| WO-2003002696-A1 | FUEL COMPOSITION | AAE TECHNOLOGIES INTERNATIONAL PLC (IE) | 2003-01-09 | — | — | WO | claimed |
| US-6462206-B1 | REDUCING KETONES AND ALDEHYDES TO THE CORRESPONDING ALCOHOL OR ALKYL GROUP, USING H2 GAS AS THE STOICHIOMETRIC REDUCTANT; FORMING CORRESPONDING LACTONES | E. I. DU PONT DE NEMOURS AND COMPANY | 2002-10-08 | — | — | US | claimed |
| CN-1348370-A | Cyclic protein tyrosine kinase inhibitors | BRISTOL MYERS SQUIBB CO (US) | 2002-05-08 | — | — | CN | claimed |
| US-6376701-B1 | Process for the transesterification of keto esters using solid acids as catalysts | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2002-04-23 | — | — | US | claimed |
| WO-2001098238-A2 | CATALYTIC HYDROGENATION OF KETONES AND ALDEHYDES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2001-12-27 | — | — | WO | claimed |
| CN-1056868-A | The synthetic method of aminoacetopropionic acid pesticide | NORTH WEST COLLEGE (CN) | 1991-12-11 | — | — | CN | claimed |
| US-4153064-A | Cigarette filters | DAICEL LTD. (JP) | 1979-05-08 | — | — | US | claimed |
| US-4125480-A | WASHING, IMPREGNATION WITH ALKALI METAL IONS | SHELL OIL COMPANY (US) | 1978-11-14 | — | — | US | claimed |