⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19509662 | 0.87 | — | — | |
| SCHEMBL4288199 | 0.86 | — | — | |
| SCHEMBL9886695 | 0.86 | ALDH1A1 (0.39) | — | |
| SCHEMBL18496313 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL18496360 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL18496361 | 0.83 | — | — | |
| SCHEMBL11357096 | 0.83 | MAPK1 (0.33) | — | |
| SCHEMBL20145103 | 0.83 | MAPK1 (0.33) | — | |
| Sulfuric Acid SCHEMBL5665307 | 0.83 | TP53 (0.37) | — | |
| Hydrochloric Acid SCHEMBL25289194 | 0.78 | — | — |
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-4296260-A1 | PREPARATION OF SPECIFIC ISOCYANATES BY CO-PHOSGENATING | Covestro Deutschland AG (DE) | 2023-12-27 | — | — | EP | claimed |
| CN-119278196-A | Production of specific isocyanates by co-phosgenation | 科思创德国股份有限公司 | 2025-01-07 | — | — | CN | disclosed |
| EP-4296260-A1 | PREPARATION OF SPECIFIC ISOCYANATES BY CO-PHOSGENATING | Covestro Deutschland AG (DE) | 2023-12-27 | — | — | EP | disclosed |
| EP-3017001-B1 | CURABLE COMPOSITION AND PROCESS FOR THE MANUFACTURE OF AN EPOXY THERMOSET | RHODIA OPERATIONS (FR) | 2019-06-19 | — | — | EP | disclosed |
| US-20040063598-A1 | Mechanically stable, liquid formulation washing, rinsing or cleaning agent doses | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) | 2004-04-01 | — | — | US | disclosed |
| EP-0764633-B1 | Process for the preparation of etherisocyanates | BAYER AG (DE) | 2001-01-03 | — | — | EP | disclosed |
| EP-0764633-A2 | Process for the preparation of etherisocyanates | BAYER AG (DE) | 1997-03-26 | — | — | EP | disclosed |
| US-3998874-A | ANTIARRHYTHMIC AGENTS, ANESTHETICS | GIST-BROCADES N.V. (NL) | 1976-12-21 | — | — | US | disclosed |