⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9483300 | 0.82 | — | — | |
| SCHEMBL574200 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL11423305 | 0.79 | — | — | |
| SCHEMBL3625671 | 0.76 | — | — | |
| SCHEMBL22260970 | 0.76 | — | — | |
| SCHEMBL24725096 | 0.76 | — | — | |
| SCHEMBL13208862 | 0.76 | — | — | |
| SCHEMBL9115572 | 0.76 | — | — | |
| SCHEMBL1744768 | 0.76 | — | — | |
| SCHEMBL291209 | 0.76 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230165965-A1 | NEW COUMARIN-POLYMER CONJUGATES AND USES THEREOF | ONYEL BIOTECH S.R.L. (IT) | 2023-06-01 | — | — | US | disclosed |
| WO-2021053586-A1 | WET-PACKED SOFT HYDROGEL OCULAR INSERTS | ALCON INC. (CH) | 2021-03-25 | — | — | WO | disclosed |
| US-8338055-B2 | System and method for electrochemical energy conversion and storage | GENERAL ELECTRIC COMPANY (US) | 2012-12-25 | — | — | US | disclosed |
| WO-2011139273-A1 | 4 SUBSTITUTED PYRAZOLOPYRIMIDINES USEFUL AS PKC-THETA INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-11-10 | — | — | WO | disclosed |
| US-20100055513-A1 | SYSTEM AND METHOD FOR ELECTROCHEMICAL ENERGY CONVERSION AND STORAGE | GENERAL ELECTRIC COMPANY (US) | 2010-03-04 | — | — | US | disclosed |