⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL1704981 | 0.90 | — | — | |
| Acetone SCHEMBL8812242 | 0.89 | — | — | |
| Acetone SCHEMBL11610957 | 0.87 | LMNA (0.38) | — | |
| Dioxane SCHEMBL1512800 | 0.85 | SMN1; SMN2 (0.55) | — | |
| Acetone SCHEMBL14359414 | 0.85 | SMN1; SMN2 (0.55) | — | |
| Acetone SCHEMBL5243854 | 0.85 | SMN1; SMN2 (0.55) | — | |
| SCHEMBL28831964 | 0.82 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL1705171 | 0.82 | ALDH1A1 (0.56) | — | |
| Dioxane SCHEMBL11791944 | 0.81 | SMN1; SMN2 (0.52) | — | |
| Bicarbonate SCHEMBL28191678 | 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
Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108242529-A | The manufacturing method and lithium ion secondary battery anode of lithium ion secondary battery anode | 丰田自动车株式会社 | 2018-07-03 | — | — | CN | disclosed |
| US-7393579-B2 | Cellulose acetate films prepared by coating methods | EASTMAN KODAK COMPANY (US) | 2008-07-01 | — | — | US | disclosed |
| US-20060188708-A1 | Cellulose acetate films prepared by coating methods | LASER PACIFIC MEDIA CORPORATION | 2006-08-24 | — | — | US | disclosed |
| EP-1367083-A2 | Optical films prepared by coating methods | EASTMAN KODAK COMPANY (US) | 2003-12-03 | — | — | EP | disclosed |
| US-5079023-A | During consumption; beverages | HERCULES INCORPORATED (US) | 1992-01-07 | — | — | US | disclosed |
| US-4307112-A | 9-Deoxy-9A-methylene isosteres of PGI2 and process for their preparation | FARMITALIA CARLO ERBA S.P.A. (IT) | 1981-12-22 | — | — | US | disclosed |
| US-4280011-A | FLAVORINGS | HERCULES INCORPORATED (US) | 1981-07-21 | — | — | US | disclosed |