⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27628761 | 0.84 | — | — | |
| SCHEMBL27593578 | 0.84 | — | — | |
| SCHEMBL2842203 | 0.81 | — | — | |
| SCHEMBL27324905 | 0.81 | — | — | |
| SCHEMBL27537187 | 0.81 | — | — | |
| SCHEMBL987812 | 0.81 | — | — | |
| SCHEMBL27568449 | 0.79 | — | — | |
| SCHEMBL5001512 | 0.78 | — | — | |
| SCHEMBL18300700 | 0.75 | NOTUM (0.31) | — | |
| SCHEMBL27519488 | 0.73 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0132717-B1 | HEAT-SENSITIVE RECORD MATERIAL | KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) | 1987-04-22 | — | — | EP | claimed |
| CN-103079689-B | Salt composition and explosive using the same | LUBRIZOL CORP | 2015-04-08 | — | — | CN | disclosed |
| CN-103079689-A | Salt composition and explosive using the same | LUBRIZOL CORP | 2013-05-01 | — | — | CN | disclosed |
| CN-101300283-A | Polyurethane-urea elastomers | BAYER MATERIALSCIENCE LLC (US) | 2008-11-05 | — | — | CN | disclosed |
| US-20080132689-A1 | Complexing using an ortho carboxy acetal; biodrug delivery | ROCHE MADISON INC | 2008-06-05 | — | — | US | disclosed |
| US-7348453-B2 | Labile linkage for compound delivery to a cell | MIRUS BIO CORPORATION (US) | 2008-03-25 | — | — | US | disclosed |
| WO-2005026253-A2 | LABILE LINKAGE FOR COMPOUND DELIVERY TO A CELL | MIRUS BIO CORPORATION (US) | 2005-03-24 | — | — | WO | disclosed |
| US-20050054604-A1 | Labile linkage for compound delivery to a cell | ROCHE MADISON INC. | 2005-03-10 | — | — | US | disclosed |