⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL996604 | 0.65 | MAPK1 (0.41) | — | |
| SCHEMBL467778 | 0.59 | — | — | |
| SCHEMBL7781320 | 0.59 | — | — | |
| SCHEMBL3801738 | 0.59 | — | — | |
| SCHEMBL10408510 | 0.59 | — | — | |
| SCHEMBL467530 | 0.59 | — | — | |
| SCHEMBL9093312 | 0.57 | — | — | |
| SCHEMBL11226823 | 0.57 | — | — | |
| SCHEMBL3799671 | 0.55 | — | — | |
| SCHEMBL10625732 | 0.55 | MAPK1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090069271-A1 | WOOD TREATMENT | STANIMIROFF IVAN LAURENCE | 2009-03-12 | — | — | US | disclosed |
| EP-1945424-A1 | WOOD TREATMENT | Stanimiroff, Ivan Laurence (NZ) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007055601-A1 | WOOD TREATMENT | STANIMIROFF IVAN LAURENCE (NZ) | 2007-05-18 | — | — | WO | disclosed |
| US-4281173-A | Preparation of unsaturated diesters by catalytic oxidative carbonylation of diolefins | ATLANTIC RICHFIELD COMPANY (US) | 1981-07-28 | — | — | US | disclosed |
| US-4195184-A | Preparation of unsaturated monoesters by catalytic oxidative carbonylation of diolefins | ATLANTIC RICHFIELD COMPANY (US) | 1980-03-25 | — | — | US | disclosed |
| US-4189599-A | Preparation of dimethyl adipate by the hydrogenation of dimethyl hex-3-endioate | ATLANTIC RICHFIELD COMPANY (US) | 1980-02-19 | — | — | US | disclosed |
| US-4171450-A | Preparation of unsaturated diesters by catalytic oxidative carbonylation of diolefins | ATLANTIC RICHFIELD COMPANY (US) | 1979-10-16 | — | — | US | disclosed |
| US-4041068-A | AS CATALYST A PALLADIUM, PLATINUM OR RHODIUM SALT WITH AN AMINE AND AN ALCOHOL | ATLANTIC RICHFIELD COMPANY (US) | 1977-08-09 | — | — | US | disclosed |