⚠ 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 | |
|---|---|---|---|---|
| Dioxane SCHEMBL2549097 | 0.96 | TTR (0.50) | — | |
| Dioxane SCHEMBL35969 | 0.96 | — | — | |
| Acetonitrile SCHEMBL11848905 | 0.96 | TTR (0.50) | — | |
| Acetonitrile SCHEMBL2815212 | 0.89 | — | — | |
| Dioxane SCHEMBL5129205 | 0.83 | TTR (0.38) | — | |
| Tetrahydrofuran SCHEMBL20135739 | 0.81 | ALDH1A1 (0.57) | — | |
| Tetrahydrofuran SCHEMBL29033463 | 0.81 | ALDH1A1 (0.57) | — | |
| Tetrahydrofuran SCHEMBL1041391 | 0.81 | — | — | |
| Tetrahydrofuran SCHEMBL509785 | 0.81 | — | — | |
| Acetonitrile SCHEMBL25193739 | 0.80 | TSHR (0.33) | — |
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-109755441-A | A kind of PP diaphragm and preparation method thereof of composite solid electrolyte modification | 宁波革鑫新能源科技有限公司 | 2019-05-14 | — | — | CN | claimed |
| CN-109755441-B | PP (polypropylene) diaphragm modified by composite solid electrolyte and preparation method thereof | 溧阳紫宸新材料科技有限公司 | 2022-03-11 | — | — | CN | disclosed |
| CN-108424745-B | Active energy ray-polymerizable resin composition, adhesive, coating agent, laminate, and use of laminate | 东洋油墨SC控股株式会社 | 2021-06-15 | — | — | CN | disclosed |
| CN-109755441-A | A kind of PP diaphragm and preparation method thereof of composite solid electrolyte modification | 宁波革鑫新能源科技有限公司 | 2019-05-14 | — | — | CN | disclosed |
| US-7018739-B2 | Positive active material and positive active material composition for lithium-sulfur battery and method of preparing positive active material composition | SAMSUNG SDI CO., LTD. (KR) | 2006-03-28 | — | — | US | disclosed |
| US-20030073000-A1 | Positive active material and positive active material composition for lithium-sulfur battery and method of preparing positive active material composition | SAMSUNG SDI CO., LTD. (KR) | 2003-04-17 | — | — | US | disclosed |
| US-5480928-A | CONTACTING SLURRY OF GRANULAR ETHYLENE OXIDE POLYMER IN INERT LIQUID HYDROCARBON DILUENT WITH INERT ALCOHOL OR ETHER DILUENT /NONSOLVENT FOR POLYMER/ AND SUSPENDING AGENT UNDER AGITATION TO FORM POLYMER-SUSPENDING AGENT DISPERSION IN SECOND DILUENT | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1996-01-02 | — | — | US | disclosed |