⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5584080 | 1.00 | — | — | |
| SCHEMBL20640999 | 1.00 | — | — | |
| SCHEMBL9326003 | 0.86 | ADH1B (0.34) | — | |
| SCHEMBL6535865 | 0.82 | TSHR (0.47) | — | |
| SCHEMBL3689106 | 0.77 | POLB (0.37) | — | |
| SCHEMBL3689110 | 0.77 | POLB (0.37) | — | |
| SCHEMBL16918384 | 0.75 | EPHX2 (0.34) | — | |
| SCHEMBL20645879 | 0.69 | — | — | |
| SCHEMBL14448751 | 0.69 | — | — | |
| SCHEMBL3178065 | 0.67 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7164047-B2 | Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous | KURARAY CO., LTD. (JP) | 2007-01-16 | — | — | US | claimed |
| US-20050020846-A1 | Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous | KURARAY CO., LTD. (JP) | 2005-01-27 | — | — | US | claimed |
| EP-1445248-A1 | PROCESSES FOR PREPARATION OF CYCLOPROPYLETHANOL, CYCLO-PROPYLACETONITRILE AND INTERMEDIATES OF BOTH | KURARAY CO., LTD. (JP) | 2004-08-11 | — | — | EP | claimed |
| US-20230233562-A1 | HETEROARYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC USE | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) | 2023-07-27 | — | — | US | disclosed |
| US-20230233562-A1 | HETEROARYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC USE | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) | 2023-07-27 | — | — | US | disclosed |
| US-20200383984-A1 | HETEROARYL COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC USE | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) | 2020-12-10 | — | — | US | disclosed |
| EP-3652178-A1 | BICYCLIC KETONE COMPOUNDS AND METHODS OF USE THEREOF | H. Hoffnabb-La Roche Ag (CH) | 2020-05-20 | — | — | EP | disclosed |
| WO-2019012063-A1 | BICYCLIC KETONE COMPOUNDS AND METHODS OF USE THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2019-01-17 | — | — | WO | disclosed |
| US-7164047-B2 | Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous | KURARAY CO., LTD. (JP) | 2007-01-16 | — | — | US | disclosed |
| US-7164047-B2 | Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous | KURARAY CO., LTD. (JP) | 2007-01-16 | — | — | US | disclosed |
| EP-1445248-A4 | PROCESSES FOR PREPARATION OF CYCLOPROPYLETHANOL, CYCLO-PROPYLACETONITRILE AND INTERMEDIATES OF BOTH | KURARAY CO (JP) | 2006-03-22 | — | — | EP | disclosed |
| US-20050020846-A1 | Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous | KURARAY CO., LTD. (JP) | 2005-01-27 | — | — | US | disclosed |
| US-20050020846-A1 | Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous | KURARAY CO., LTD. (JP) | 2005-01-27 | — | — | US | disclosed |
| EP-1445248-A1 | PROCESSES FOR PREPARATION OF CYCLOPROPYLETHANOL, CYCLO-PROPYLACETONITRILE AND INTERMEDIATES OF BOTH | KURARAY CO., LTD. (JP) | 2004-08-11 | — | — | EP | disclosed |
| EP-1445248-A1 | PROCESSES FOR PREPARATION OF CYCLOPROPYLETHANOL, CYCLO-PROPYLACETONITRILE AND INTERMEDIATES OF BOTH | KURARAY CO., LTD. (JP) | 2004-08-11 | — | — | EP | disclosed |
| JP-2003306471-A | METHOD FOR PRODUCING 2-CYCLOPROPYLETHYLAMINE | KURARAY CO LTD | 2003-10-28 | — | — | JP | disclosed |
| JP-2003300947-A | METHOD FOR PRODUCING CYCLOPROPYLACETONITRILE | KURARAY CO LTD | 2003-10-21 | — | — | JP | disclosed |
| WO-2003042145-A1 | PROCESSES FOR PREPARATION OF CYCLOPROPYLETHANOL, CYCLO- PROPYLACETONITRILE AND INTERMEDIATES OF BOTH | KURARAY CO.,LTD. (JP) | 2003-05-22 | — | — | WO | disclosed |