⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL823032 | 0.72 | — | — | |
| Methane SCHEMBL10011954 | 0.69 | — | — | |
| SCHEMBL24445323 | 0.64 | — | — | |
| SCHEMBL3307240 | 0.64 | — | — | |
| Isobutyraldehyde SCHEMBL2635854 | 0.62 | ADH1B (0.38) | — | |
| Isobutyraldehyde SCHEMBL2996 | 0.62 | — | — | |
| SCHEMBL1512171 | 0.62 | — | — | |
| Isobutyraldehyde SCHEMBL18287436 | 0.62 | — | — | |
| Isobutyraldehyde SCHEMBL788159 | 0.62 | ADH1B (0.38) | — | |
| SCHEMBL7590510 | 0.62 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103635468-B | Process for preparing enamines | DOW AGROSCIENCES LLC (US) | 2016-03-30 | — | — | CN | claimed |
| CN-105175358-A | Processes for the preparation of enamines | DOW AGROSCIENCE LLC | 2015-12-23 | — | — | CN | claimed |
| CN-103491963-B | Process for preparing enamines | DOW AGROSCIENCES LLC (US) | 2015-09-16 | — | — | CN | claimed |
| CN-103635468-A | Process for preparing enamines | DOW AGROSCIENCES LLC | 2014-03-12 | — | — | CN | claimed |
| CN-103491963-A | Process for preparing enamines | DOW AGROSCIENCES LLC | 2014-01-01 | — | — | CN | claimed |
| CN-103298342-A | Processes for the preparation of enamines | DOW AGROSCIENCES LLC | 2013-09-11 | — | — | CN | claimed |
| CN-105175358-A | Processes for the preparation of enamines | DOW AGROSCIENCE LLC | 2015-12-23 | — | — | CN | disclosed |
| CN-102321097-A | Synthesis method of screw ring orthocarbonicester monomer | UNIV SHENYANG CHEMICAL TECH | 2012-01-18 | — | — | CN | disclosed |
| US-7968734-B2 | Organocatalysts and methods of use in chemical synthesis | STC.UNM (US) | 2011-06-28 | — | — | US | disclosed |