⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3286850 | 0.72 | — | — | |
| SCHEMBL9284610 | 0.72 | — | — | |
| SCHEMBL7144993 | 0.67 | APLNR (0.36) | — | |
| SCHEMBL3784264 | 0.67 | — | — | |
| SCHEMBL3019375 | 0.67 | — | — | |
| SCHEMBL1163814 | 0.65 | — | — | |
| SCHEMBL821860 | 0.64 | — | — | |
| SCHEMBL3002264 | 0.63 | — | — | |
| SCHEMBL9094601 | 0.63 | — | — | |
| SCHEMBL9098453 | 0.63 | — | — |
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 214 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117209521-A | Preparation method of propynyl chloride | 台州道致科技股份有限公司 | 2023-12-12 | — | — | CN | claimed |
| CN-115557984-A | Synthetic method of 3-trimethylsilyl propiolic aldehyde | 上海易恩化学技术有限公司 | 2023-01-03 | — | — | CN | claimed |
| CN-111825679-B | Novel spiro-pyrrole [2, 1-b ] quinazolinone derivative and preparation method and application thereof | 广西师范大学 | 2022-04-12 | — | — | CN | claimed |
| CN-112480131-B | Porphyrin compound, preparation method thereof and application thereof in secondary battery anode material | 湘潭大学 | 2022-01-04 | — | — | CN | claimed |
| CN-112480131-A | Porphyrin compound, preparation method thereof and application thereof in secondary battery anode material | 湘潭大学 | 2021-03-12 | — | — | CN | claimed |
| CN-111825679-A | Novel spiro-pyrrole [2, 1-b ] quinazolinone derivative and preparation method and application thereof | 广西师范大学 | 2020-10-27 | — | — | CN | claimed |
| CN-109135493-A | A kind of useless paint processing method of furniture paint spraying | 温州职业技术学院 | 2019-01-04 | — | — | CN | claimed |
| CN-1119321-C | Asymetric synthesis of chiral beta-amino acids | SEARLE & CO (US) | 2003-08-27 | — | — | CN | claimed |
| EP-0912495-B1 | ASYMETRIC SYNTHESIS OF CHIRAL BETA-AMINO ACIDS | SEARLE & CO (US) | 2001-11-21 | — | — | EP | claimed |
| EP-0839128-B1 | PROCESS FOR THE PREPARATION OF ETHYL 3S-[[4-[[4-(AMINOIMINOMETHYL)PHENYL]AMINO]-1,4-DIOXOBUTYL]AMINO]-4-PENTYNOATE | SEARLE & CO (US) | 2000-04-05 | — | — | EP | claimed |
| CN-1225084-A | Asymetric synthesis of chiral beta-amino acids | SEARLE & CO (US) | 1999-08-04 | — | — | CN | claimed |
| EP-0912495-A1 | ASYMETRIC SYNTHESIS OF CHIRAL BETA-AMINO ACIDS | G.D. SEARLE & CO. (US) | 1999-05-06 | — | — | EP | claimed |
| US-5840961-A | Asymmetric synthesis of chiral beta-amiNo acids | G. D. SEARLE & CO. (US) | 1998-11-24 | — | — | US | claimed |
| EP-0839128-A1 | PROCESS FOR THE PREPARATION OF ETHYL 3S-[[4-[[4-(AMINOIMINOMETHYL)PHENYL]AMINO]-1,4-DIOXOBUTYL]AMINO]-4-PENTYNOATE | G.D. SEARLE & CO. (US) | 1998-05-06 | — | — | EP | claimed |
| WO-1998002410-A1 | ASYMETRIC SYNTHESIS OF CHIRAL BETA-AMINO ACIDS | G.D. SEARLE & CO. (US) | 1998-01-22 | — | — | WO | claimed |
| US-5631399-A | MULTISTAGE SYNTHESIS USING TRIMETHYLSILYLACETYLENE WITH BUTYLLITHIUM AND FORMYLMORPHOLINE, THEN ACID HYDROLYSIS | G. D. SEARLE & CO. (US) | 1997-05-20 | — | — | US | claimed |
| WO-1997003947-A1 | PROCESS FOR THE PREPARATION OF ETHYL 3S-[[4-[[4-(AMINOIMINOMETHYL)PHENYL]AMINO]-1,4-DIOXOBUTYL]AMINO]-4-PENTYNOATE | G.D. SEARLE & CO. (US) | 1997-02-06 | — | — | WO | claimed |
| US-5536869-A | Process for the preparation of ethyl 3S-[4-[[4-(aminoiminomethyl)phenyl]amino]-1,4-dioxobutyl]amino]-4-pentynoate | G. D. SEARLE & CO. (US) | 1996-07-16 | — | — | US | claimed |
| JP-9100285-A | — | — | None | — | — | JP | disclosed |
| JP-H00967382-A | — | — | 0001-01-01 | — | — | JP | disclosed |