⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9764132 | 0.84 | ALDH1A1 (0.36) | — | |
| SCHEMBL3667000 | 0.82 | EP300 (0.43) | — | |
| SCHEMBL10663968 | 0.80 | EP300 (0.47) | — | |
| SCHEMBL10661280 | 0.80 | EP300 (0.47) | — | |
| SCHEMBL10666394 | 0.80 | EP300 (0.47) | — | |
| SCHEMBL3065105 | 0.77 | — | — | |
| SCHEMBL17811841 | 0.76 | — | — | |
| SCHEMBL10789764 | 0.76 | — | — | |
| SCHEMBL10789771 | 0.76 | — | — | |
| SCHEMBL11578699 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250333375-A1 | CYANOCARBON COMPOSITIONS | ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) | 2025-10-30 | — | — | US | disclosed |
| US-12215070-B2 | Cyanocarbon compositions | ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) | 2025-02-04 | — | — | US | disclosed |
| EP-4061795-A1 | COMPOSITIONS COMPRISING TRISCYANOHEXANE | Ascend Performance Materials Operations LLC (US) | 2022-09-28 | — | — | EP | disclosed |
| CN-114555554-A | Composition comprising hexanetricarbonitrile | 奥升德功能材料运营有限公司 | 2022-05-27 | — | — | CN | disclosed |
| US-20210155579-A1 | CYANOCARBON COMPOSITIONS | ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) | 2021-05-27 | — | — | US | disclosed |
| WO-2021102286-A1 | COMPOSITIONS COMPRISING TRISCYANOHEXANE | ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) | 2021-05-27 | — | — | WO | disclosed |
| EP-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |
| US-4719245-A | TRIMERIZATION CATALYST | THE DOW CHEMICAL COMPANY (US) | 1988-01-12 | — | — | US | disclosed |
| US-4703099-A | CATALYTICALLY TRIMERIZING ISOCYANATES | THE DOW CHEMICAL COMPANY (US) | 1987-10-27 | — | — | US | disclosed |
| US-4632989-A | KETENE AMINAL-OLEFIN REACTION PRODUCT AS CATALYSTS | THE DOW CHEMICAL COMPANY (US) | 1986-12-30 | — | — | US | disclosed |
| US-4536490-A | REACTION PRODUCT OF KETENE-AMINAL AND UNSATURATED COMPOUND | THE UPJOHN COMPANY (US) | 1985-08-20 | — | — | US | disclosed |