⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8295396 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL7859377 | 0.98 | ALDH1A1 (0.34) | — | |
| Nitric Acid SCHEMBL5155183 | 0.94 | ALDH1A1 (0.32) | — | |
| SCHEMBL5151024 | 0.85 | ALDH1A1 (0.42) | — | |
| SCHEMBL15570505 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL7860680 | 0.81 | ALDH1A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL7853717 | 0.78 | ALDH1A1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL7856793 | 0.77 | GMNN (0.39) | — | |
| SCHEMBL8080510 | 0.77 | S1PR2 (0.42) | — | |
| SCHEMBL10542839 | 0.76 | ALDH1A1 (0.39) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2887927-B1 | EXTENDED RELEASE COMPOSITIONS OF AN AMINO-C2-C6-ALKYL NITRATE | CARDIOLYNX AG (CH) | 2018-03-28 | — | — | EP | disclosed |
| US-20180036259-A1 | NO DONORS FOR THE TREATMENT OF IMPAIRED TISSUE PERFUSION | MIRANDAPHARMACEUTICALS AG (CH) | 2018-02-08 | — | — | US | disclosed |
| US-20180008558-A1 | EXTENDED RELEASE COMPOSITIONS OF AN AMINOALKYL NITRATE | CARDIOLYNX AG (CH) | 2018-01-11 | — | — | US | disclosed |
| US-20170100350-A1 | EXTENDED RELEASE COMPOSITIONS OF AN AMINOALKYL NITRATE | CARDIOLYNX AG (CH) | 2017-04-13 | — | — | US | disclosed |
| WO-2016135262-A1 | NO DONORS FOR THE TREATMENT OF IMPAIRED TISSUE PERFUSION | CARDIOLYNX AG (CH) | 2016-09-01 | — | — | WO | disclosed |
| WO-2016135263-A1 | NO DONORS FOR THE TREATMENT OF STRESS-INDUCED PULMONARY HAEMORRHAGE IN ANIMALS | SCHERHAG ARMIN (CH) | 2016-09-01 | — | — | WO | disclosed |
| CN-104869985-A | Extended release compositions of an aminoalkyl nitrate | CARDIOLYNX AG | 2015-08-26 | — | — | CN | disclosed |
| US-20150216992-A1 | EXTENDED RELEASE COMPOSITIONS OF AN AMINOALKYL NITRATE | CARDIOLYNX AG (CH) | 2015-08-06 | — | — | US | disclosed |
| EP-2887927-A1 | EXTENDED RELEASE COMPOSITIONS OF AN AMINOALKYL NITRATE | Cardiolynx AG (CH) | 2015-07-01 | — | — | EP | disclosed |
| WO-2014029841-A1 | EXTENDED RELEASE COMPOSITIONS OF AN AMINOALKYL NITRATE | CARDIOLYNX AG (CH) | 2014-02-27 | — | — | WO | disclosed |