⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL263810 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL508111 | 0.83 | — | — | |
| SCHEMBL6261190 | 0.83 | — | — | |
| Bicarbonate SCHEMBL5014541 | 0.76 | CYP1A2 (0.33) | — | |
| Nitric Acid SCHEMBL7455687 | 0.75 | CA5A (0.38) | — | |
| Nitric Acid SCHEMBL241104 | 0.75 | CA5A (0.38) | — | |
| Sulfuric Acid SCHEMBL8648494 | 0.74 | KDM4E (0.35) | — | |
| SCHEMBL6261197 | 0.73 | ALDH1A1 (0.31) | — | |
| Guanidine SCHEMBL7622738 | 0.72 | CA5A (0.35) | — | |
| Pimagedine SCHEMBL2702590 | 0.71 | 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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0964843-B1 | GAS GENERANTS COMPRISING TRANSITION METAL NITRITE COMPLEXES | AUTOMOTIVE SYSTEMS LAB (US) | 2005-11-02 | — | — | EP | claimed |
| EP-0964842-B1 | GAS GENERANT COMPLEX OXIDIZERS WITH MULTIMETAL CATIONS | AUTOMOTIVE SYSTEMS LAB (US) | 2004-06-30 | — | — | EP | claimed |
| EP-0950647-B1 | Gas generating composition for air bag | DAICEL CHEM (JP) | 2003-04-09 | — | — | EP | claimed |
| US-6468369-B1 | GUANIDINE DERIVATIVE, PHASE STABILIZED AMMONIUM NITRATE AND SILICON COMPOUND; IMPROVED COMBUSTION BEHAVIOR, ENHANCED HANDLING SAFETY | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2002-10-22 | — | — | US | claimed |
| EP-0964843-A4 | GAS GENERANTS COMPRISING TRANSITION METAL NITRITE COMPLEXES | AUTOMOTIVE SYSTEMS LAB (US) | 2001-02-28 | — | — | EP | claimed |
| EP-0964842-A4 | GAS GENERANT COMPLEX OXIDIZERS WITH MULTIMETAL CATIONS | AUTOMOTIVE SYSTEMS LAB (US) | 2000-10-04 | — | — | EP | claimed |
| US-6077371-A | HIGH NITROGEN GAS GENERANT COMPOSITIONS, USEFUL FOR INFLATING PASSENGER RESTRAINT GAS INFLATOR BAGS | AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) | 2000-06-20 | — | — | US | claimed |
| EP-0964842-A1 | GAS GENERANT COMPLEX OXIDIZERS WITH MULTIMETAL CATIONS | AUTOMOTIVE SYSTEMS LABORATORY INC. (US) | 1999-12-22 | — | — | EP | claimed |
| EP-0964843-A2 | GAS GENERANTS COMPRISING TRANSITION METAL NITRITE COMPLEXES | AUTOMOTIVE SYSTEMS LABORATORY INC. (US) | 1999-12-22 | — | — | EP | claimed |
| EP-0950647-A1 | Gas generating composition for air bag | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1999-10-20 | — | — | EP | claimed |
| US-5962808-A | Gas generant complex oxidizers | AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) | 1999-10-05 | — | — | US | claimed |
| WO-1998039275-A1 | GAS GENERANTS COMPRISING CARBONATO METAL AMMINE COMPLEXES | AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) | 1998-09-11 | — | — | WO | claimed |
| WO-1998039274-A1 | GAS GENERANT COMPLEX OXIDIZERS WITH MULTIMETAL CATIONS | AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) | 1998-09-11 | — | — | WO | claimed |
| WO-1998037040-A1 | GAS GENERATOR PROPELLANT COMPOSITIONS | AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) | 1998-08-27 | — | — | WO | claimed |
| WO-1998036938-A2 | GAS GENERANTS COMPRISING TRANSITION METAL NITRITE COMPLEXES | AUTOMOTIVE SYSTEMS LABORATORY, INC. (US) | 1998-08-27 | — | — | WO | claimed |
| EP-0238210-A2 | Solid explosive composition | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-09-23 | — | — | EP | claimed |
| JP-11314992-A | — | — | None | — | — | JP | disclosed |
| US-20120261040-A1 | GAS-GENERATING AGENT COMPOSITION | DAICEL CORPORATION (JP) | 2012-10-18 | — | — | US | disclosed |
| US-4722757-A | CONTAINING NUCLEATING AGENT TO PROMOTE CRYSTALLIZATION | IMPERIAL CHEMICAL INDUSTRIES (GB) | 1988-02-02 | — | — | US | disclosed |
| EP-0238210-A2 | Solid explosive composition | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-09-23 | — | — | EP | disclosed |