⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9452633 | 0.84 | — | — | |
| SCHEMBL18407028 | 0.79 | CA1 (0.35) | — | |
| SCHEMBL172878 | 0.79 | CA1 (0.35) | — | |
| SCHEMBL13311912 | 0.77 | CA1 (0.33) | — | |
| SCHEMBL6900128 | 0.77 | CA1 (0.44) | — | |
| SCHEMBL9323765 | 0.70 | GSR (0.36) | — | |
| SCHEMBL8626870 | 0.70 | — | — | |
| SCHEMBL11798747 | 0.69 | — | — | |
| SCHEMBL17718438 | 0.68 | — | — | |
| SCHEMBL17264747 | 0.68 | — | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0157828-B1 | PROCESS FOR THE PREPARATION OF URETHANES | CATALYTICA ASSOCIATES (US) | 1994-01-12 | — | — | EP | disclosed |
| EP-0220205-A4 | PROCESS FOR THE PREPARATION OF URETHANES. | CATALYTICA ASSOCIATES (US) | 1988-04-27 | — | — | EP | disclosed |
| EP-0215848-A4 | CARBONYLATION PROCESS. | CATALYTICA ASSOCIATES (US) | 1988-04-26 | — | — | EP | disclosed |
| US-4709073-A | Process for the preparation of urethanes | CATALYTICA ASSOCIATES (US) | 1987-11-24 | — | — | US | disclosed |
| US-4705883-A | Carbonylation process | CATALYTICA ASSOCIATES (US) | 1987-11-10 | — | — | US | disclosed |
| US-4687872-A | Process for the preparation of urethanes | CATALYTICA ASSOCIATES (US) | 1987-08-18 | — | — | US | disclosed |
| EP-0220205-A1 | PROCESS FOR THE PREPARATION OF URETHANES | CATALYTICA ASSOCIATES (US) | 1987-05-06 | — | — | EP | disclosed |
| EP-0215848-A1 | CARBONYLATION PROCESS | CATALYTICA ASSOCIATES (US) | 1987-04-01 | — | — | EP | disclosed |
| EP-0157828-A4 | PROCESS FOR THE PREPARATION OF URETHANES. | CATALYTICA ASSOCIATES (US) | 1987-01-22 | — | — | EP | disclosed |
| US-4629804-A | Process for preparation of urethanes | CATALYTICA ASSOCIATES (US) | 1986-12-16 | — | — | US | disclosed |
| WO-1986005178-A1 | PROCESS FOR THE PREPARATION OF URETHANES | CATALYTICA ASSOCIATES (US) | 1986-09-12 | — | — | WO | disclosed |
| WO-1986005179-A1 | CARBONYLATION PROCESS | CATALYTICA ASSOCIATES (US) | 1986-09-12 | — | — | WO | disclosed |
| US-4603216-A | RUTHENIUM-PHOSPHINE CATALYST | CATALYTICA ASSOCIATES (US) | 1986-07-29 | — | — | US | disclosed |
| US-4600793-A | Process for the preparation of urethanes | CATALYTICA ASSOCIATES (US) | 1986-07-15 | — | — | US | disclosed |
| EP-0157828-A1 | PROCESS FOR THE PREPARATION OF URETHANES. | CATALYTICA ASSOCIATES (US) | 1985-10-16 | — | — | EP | disclosed |
| WO-1985001285-A1 | PROCESS FOR THE PREPARATION OF URETHANES | CATALYTICA ASSOCIATES (US) | 1985-03-28 | — | — | WO | disclosed |
| US-4070391-A | Process for producing isocyanate from nitro compounds and carbon monoxide using rhodium oxide catalysts | ETHYL CORPORATION (US) | 1978-01-24 | — | — | US | disclosed |
| US-4052420-A | PROCESS FOR PRODUCING DIURETHANE FROM DINITRO COMPOUNDS, HYDROXYL COMPOUNDS AND CARBON MONOXIDE | ETHYL CORPORATION (US) | 1977-10-04 | — | — | US | disclosed |
| US-4052437-A | PROCESS FOR PRODUCING URETHANE FROM NITRO COMPOUNDS, HYDROXYL COMPOUNDS AND CARBON MONOXIDE USING RHODIUM OXIDE CATALYSTS | ETHYL CORPORATION (US) | 1977-10-04 | — | — | US | disclosed |
| US-3993685-A | Process for the production of urethanes | ATLANTIC RICHFIELD COMPANY (US) | 1976-11-23 | — | — | US | disclosed |