⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10672825 | 1.00 | — | — | |
| SCHEMBL10387230 | 1.00 | — | — | |
| SCHEMBL23961082 | 0.75 | — | — | |
| SCHEMBL28581083 | 0.72 | TDP1 (0.50) | — | |
| SCHEMBL11805179 | 0.72 | — | — | |
| SCHEMBL11805182 | 0.72 | — | — | |
| SCHEMBL3387055 | 0.72 | — | — | |
| SCHEMBL12573994 | 0.69 | — | — | |
| SCHEMBL436544 | 0.69 | — | — | |
| SCHEMBL892030 | 0.69 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090042957-A1 | Substituted Oxyarenes | BAYER CROPSCIENCE AG (DE) | 2009-02-12 | — | — | US | claimed |
| EP-1831145-A1 | SUBSTITUTED OXYARENES | Bayer CropScience Aktiengesellschaft (DE) | 2007-09-12 | — | — | EP | claimed |
| WO-2006069685-A1 | SUBSTITUTED OXYARENES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2006-07-06 | — | — | WO | claimed |
| US-4433147-A | ALKYLATION CARBO ACID WITH 3-CHLORO-1-METHOXY-PROPENE, BROMOACYLATION, REACTING WITH 2,4,5,6-TETRACAMINOPYRIMIDINE, CYCLIZATION AND DEHYDROGENATION | DEGRAW JR JOSEPH I (US) | 1984-02-21 | — | — | US | claimed |
| US-20090042957-A1 | Substituted Oxyarenes | BAYER CROPSCIENCE AG (DE) | 2009-02-12 | — | — | US | disclosed |
| EP-1831145-A1 | SUBSTITUTED OXYARENES | Bayer CropScience Aktiengesellschaft (DE) | 2007-09-12 | — | — | EP | disclosed |
| WO-2006069685-A1 | SUBSTITUTED OXYARENES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2006-07-06 | — | — | WO | disclosed |
| WO-2001030782-A2 | NOVEL HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2001-05-03 | — | — | WO | disclosed |
| US-5536734-A | FUNGICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1996-07-16 | — | — | US | disclosed |
| US-4891451-A | CATALYTIC ELIMINATION OF ALCOHOL FROM ACETAL OF KETAL | BASF AKTIENGESELLSCHAFT (DE) | 1990-01-02 | — | — | US | disclosed |
| EP-0299286-A1 | Process for the preparation of vinyl ethers | BASF Aktiengesellschaft (DE) | 1989-01-18 | — | — | EP | disclosed |
| US-4753939-A | ADMINISTERING 10-ETHYL-10DEAZAMINOPTERIN | SRI INTERNATIONAL (US) | 1988-06-28 | — | — | US | disclosed |
| US-4698339-A | BETA-LACTAMASE INHIBITORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1987-10-06 | — | — | US | disclosed |
| EP-0137403-A2 | Carbapenems, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1985-04-17 | — | — | EP | disclosed |
| US-4433147-A | ALKYLATION CARBO ACID WITH 3-CHLORO-1-METHOXY-PROPENE, BROMOACYLATION, REACTING WITH 2,4,5,6-TETRACAMINOPYRIMIDINE, CYCLIZATION AND DEHYDROGENATION | DEGRAW JR JOSEPH I (US) | 1984-02-21 | — | — | US | disclosed |
| US-4393064-A | 10-DEAZAMINOPTERIN | SRI INTERNATIONAL (US) | 1983-07-12 | — | — | US | disclosed |
| US-4369319-A | TREATMENT OF LEUKEMIA AND TUMORS | DEGRAW JR JOSEPH I (US) | 1983-01-18 | — | — | US | disclosed |