⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10436134 | 0.77 | — | — | |
| SCHEMBL28239995 | 0.76 | — | — | |
| SCHEMBL9427892 | 0.76 | — | — | |
| SCHEMBL4175373 | 0.76 | — | — | |
| SCHEMBL5115832 | 0.76 | — | — | |
| SCHEMBL665120 | 0.72 | — | — | |
| SCHEMBL9517698 | 0.71 | FDPS (0.50) | — | |
| SCHEMBL10697241 | 0.71 | — | — | |
| SCHEMBL5657617 | 0.71 | CYP19A1 (0.48) | — | |
| SCHEMBL18538766 | 0.70 | POLB (0.43) | — |
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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10287220-B2 | Fluorination method | OXFORD UNIVERSITY INNOVATION LIMITED (GB) | 2019-05-14 | — | — | US | claimed |
| CN-108484654-A | Hydrophobic spontaneous combustion N-alkyl triazole dicyano borane complex and preparation method thereof | 南京工业大学 | 2018-09-04 | — | — | CN | claimed |
| US-20160280691-A1 | TRIAZOLE INTERMEDIATES USEFUL IN THE SYNTHESIS OF PROTECTED N-ALKYLTRIAZOLECARBALDEHYDES | BIOMARIN PHARMACEUTICAL INC. | 2016-09-29 | — | — | US | claimed |
| EP-3066084-A1 | TRIAZOLE INTERMEDIATES USEFUL IN THE SYNTHESIS OF PROTECTED N-ALKYLTRIAZOLECARBALDEHYDES | Medivation Technologies, Inc. (US) | 2016-09-14 | — | — | EP | claimed |
| CN-105916846-A | Triazole intermediates useful in the synthesis of protected N-alkyltriazolecarbaldehydes | 麦迪韦逊科技有限公司 | 2016-08-31 | — | — | CN | claimed |
| WO-2015069851-A1 | TRIAZOLE INTERMEDIATES USEFUL IN THE SYNTHESIS OF PROTECTED N-ALKYLTRIAZOLECARBALDEHYDES | BIOMARIN PHARMACEUTICAL INC. (US) | 2015-05-14 | — | — | WO | claimed |
| US-5854062-A | Catalyzed enantiomeric selection of 1,2-diols and their cyclization to produce oxiranes | ZENECA LIMITED (GB) | 1998-12-29 | — | — | US | claimed |
| EP-0695362-A1 | CHIRAL SYNTHESIS OF TERTIARY ALCOHOLS WITH A HYDROLASE | ZENECA LIMITED (GB) | 1996-02-07 | — | — | EP | claimed |
| WO-1994024305-A1 | CHIRAL SYNTHESIS OF TERTIARY ALCOHOLS WITH A HYDROLASE | ZENECA LIMITED (GB) | 1994-10-27 | — | — | WO | claimed |
| EP-0132730-B1 | 3-(1,2,4-TRIAZOL-1-YL)-1-PROPENES | BAYER AG (DE) | 1988-05-18 | — | — | EP | claimed |
| US-4740515-A | 3-(1,2,4-triazol-1-yl)-prop-1-ene fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1988-04-26 | — | — | US | claimed |
| EP-0132730-A1 | 3-(1,2,4-Triazol-1-yl)-1-propenes | BAYER AG (DE) | 1985-02-13 | — | — | EP | claimed |
| JP-5202004-A | — | — | None | — | — | JP | disclosed |
| JP-5202004-A | — | — | None | — | — | JP | disclosed |
| JP-6172357-A | — | — | None | — | — | JP | disclosed |
| CN-114672025-B | Heterocycle-containing POSS siloxane compound and preparation method and application thereof | 波米科技有限公司 | 2022-12-02 | — | — | CN | disclosed |
| US-4740515-A | 3-(1,2,4-triazol-1-yl)-prop-1-ene fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1988-04-26 | — | — | US | disclosed |
| EP-0132730-A1 | 3-(1,2,4-Triazol-1-yl)-1-propenes | BAYER AG (DE) | 1985-02-13 | — | — | EP | disclosed |
| EP-0132730-A1 | 3-(1,2,4-Triazol-1-yl)-1-propenes | BAYER AG (DE) | 1985-02-13 | — | — | EP | disclosed |
| EP-0132730-A1 | 3-(1,2,4-Triazol-1-yl)-1-propenes | BAYER AG (DE) | 1985-02-13 | — | — | EP | disclosed |