⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL38647 | 1.00 | — | — | |
| SCHEMBL38956 | 1.00 | — | — | |
| SCHEMBL3004330 | 0.94 | — | — | |
| SCHEMBL2834045 | 0.92 | ALDH1A1 (0.35) | — | |
| SCHEMBL3742314 | 0.82 | — | — | |
| SCHEMBL14759829 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL9640680 | 0.76 | — | — | |
| SCHEMBL2964675 | 0.76 | ALDH1A1 (0.32) | — | |
| SCHEMBL5693065 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL2964678 | 0.76 | ALDH1A1 (0.32) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4699921-A | CIRCULATION AMELIORATING AND ANTIULCER EFFECT | MITSUBISHI YUKA PHARMACEUTICAL CO., LTD. (JP) | 1987-10-13 | — | — | US | claimed |
| US-9388345-B2 | Hydrocarbon synthesis methods, apparatus, and systems | SARTEC CORPORATION (US) | 2016-07-12 | — | — | US | disclosed |
| US-20140046104-A1 | HYDROCARBON SYNTHESIS METHODS, APPARATUS, AND SYSTEMS | SARTEC CORPORATION | 2014-02-13 | — | — | US | disclosed |
| WO-2014008355-A1 | HYDROCARBON SYNTHESIS METHODS, APPARATUS, AND SYSTEMS | MCNEFF CLAYTON V (US) | 2014-01-09 | — | — | WO | disclosed |
| US-20130210143-A1 | NOVEL METHODS FOR PREVENTING OR TREATING DIABETES | FUNDACION PUBLICA ANDALUZA PROGRESO Y SALUD (ES) | 2013-08-15 | — | — | US | disclosed |
| EP-2598125-A2 | NOVEL METHODS FOR PREVENTING OR TREATING DIABETES | Fundación Pública Andaluza Progreso Y Salud (ES) | 2013-06-05 | — | — | EP | disclosed |
| WO-2011144725-A2 | NOVEL METHODS FOR PREVENTING OR TREATING DIABETES | FUNDACIÓN PÚBLICA ANDALUZA PROGRESO Y SALUD (ES) | 2011-11-24 | — | — | WO | disclosed |
| EP-1078027-B1 | UTILIZATION OF BICYCLIC ALDEHYDES AS ODORIFEROUS AGENTS | KAO CORP (JP) | 2004-12-22 | — | — | EP | disclosed |
| US-6537963-B1 | The use of bicyclic aldehydes as odorous materials, which can be produced through partial or total hydroformylation of bicyclo(3. 3.0)-oct(adi)enes, is described. The fragrance enhancing capacity of the compounds is described in methods | COGNIS DEUTSCHLAND GMBH (DE) | 2003-03-25 | — | — | US | disclosed |
| EP-1078027-A1 | UTILIZATION OF BICYCLIC ALDEHYDES AS ODORIFEROUS AGENTS | Cognis Deutschland GmbH (DE) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999054429-A1 | UTILIZATION OF BICYCLIC ALDEHYDES AS ODORIFEROUS AGENTS | COGNIS DEUTSCHLAND GMBH (DE) | 1999-10-28 | — | — | WO | disclosed |
| US-4774341-A | CARBOXYLIC ACIDS OR ESTER DERIVATIVES, ANTICOAGULANTS | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1988-09-27 | — | — | US | disclosed |
| EP-0153822-A1 | Method for preparing cis-bicyclo(3.3.0)octylidene derivative | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1985-09-04 | — | — | EP | disclosed |