⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9066145 | 0.66 | OPRM1 (0.31) | — | |
| SCHEMBL29262766 | 0.63 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL7518258 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL30924492 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL19981082 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL22429 | 0.61 | THRB (0.32) | — | |
| SCHEMBL6428686 | 0.61 | THRB (0.36) | — | |
| SCHEMBL4631210 | 0.60 | CFTR (0.32) | — | |
| SCHEMBL28634495 | 0.59 | OPRM1 (0.32) | — | |
| SCHEMBL23239949 | 0.54 | ALDH1A1 (0.42) | — |
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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7572303-B2 | A symmetrical dialkyl carbonate, a metal, borong, silicon, or group 7 compound, a hydrogen or hydrocarbon-based fuel, an oxidizer, and a metallic cocatalyst; minimized hydrolysis; improved combustion and storage stability | OCTANE INTERNATIONAL, LTD. (US) | 2009-08-11 | — | — | US | disclosed |
| EP-0748364-B1 | UNLEADED FUEL COMPOSITIONS | ORR WILLIAM C (US) | 2007-11-21 | — | — | EP | disclosed |
| EP-0954558-B1 | FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY | ORR WILLIAM C (US) | 2006-06-14 | — | — | EP | disclosed |
| US-20050044778-A1 | Fuel compositions employing catalyst combustion structure | OCTANE INTERNATIONAL, LTD. | 2005-03-03 | — | — | US | disclosed |
| US-20040237384-A1 | Fuel compositions exhibiting improved fuel stability | OCTANE INTERNATIONAL, LTD. | 2004-12-02 | — | — | US | disclosed |
| US-6652608-B1 | Fuel compositions exhibiting improved fuel stability | OCTANE INTERNATIONAL, LTD. | 2003-11-25 | — | — | US | disclosed |
| US-6039772-A | Non leaded fuel composition | OCTANE INTERNATIONAL, LTD. | 2000-03-21 | — | — | US | disclosed |
| EP-0954558-A1 | FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY | ORR, William C. (US) | 1999-11-10 | — | — | EP | disclosed |
| EP-0235280-B2 | NONLEADED FUEL COMPOSITION | ORR WILLIAM C (US) | 1999-06-23 | — | — | EP | disclosed |
| WO-1998026028-A1 | FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY | ORR WILLIAM C (US) | 1998-06-18 | — | — | WO | disclosed |
| EP-0763079-A1 | VAPOR PHASE COMBUSTION METHODS AND COMPOSITIONS | ORR, William C. (US) | 1997-03-19 | — | — | EP | disclosed |
| WO-1996040844-A1 | VAPOR PHASE COMBUSTION METHOD AND COMPOSITIONS II | ORR WILLIAM C (US) | 1996-12-19 | — | — | WO | disclosed |
| EP-0748364-A1 | UNLEADED MMT FUEL COMPOSITIONS | ORR, William C. (US) | 1996-12-18 | — | — | EP | disclosed |
| WO-1995033022-A1 | VAPOR PHASE COMBUSTION METHODS AND COMPOSITIONS | ORR WILLIAM C (US) | 1995-12-07 | — | — | WO | disclosed |
| WO-1995023836-A1 | UNLEADED MMT FUEL COMPOSITIONS | ORR WILLIAM C (US) | 1995-09-08 | — | — | WO | disclosed |
| EP-0656045-A1 | UNLEADED MMT FUEL COMPOSITION | ORR, William C. (US) | 1995-06-07 | — | — | EP | disclosed |
| WO-1994004636-A1 | UNLEADED MMT FUEL COMPOSITION | ORR WILLIAM C (US) | 1994-03-03 | — | — | WO | disclosed |
| EP-0235280-A4 | NONLEADED FUEL COMPOSITION. | ORR WILLIAM C (US) | 1988-01-07 | — | — | EP | disclosed |
| EP-0235280-A1 | NONLEADED FUEL COMPOSITION. | ORR WILLIAM C (US) | 1987-09-09 | — | — | EP | disclosed |
| WO-1987001384-A1 | NONLEADED FUEL COMPOSITION | ORR WILLIAM C (US) | 1987-03-12 | — | — | WO | disclosed |