⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL3053670 | 0.97 | — | — | |
| Fluoride Ion SCHEMBL7027242 | 0.97 | — | — | |
| SCHEMBL3628351 | 0.83 | — | — | |
| SCHEMBL3631072 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL7035333 | 0.73 | — | — | |
| SCHEMBL6046915 | 0.71 | ALDH1A1 (0.37) | — | |
| SCHEMBL13385232 | 0.71 | — | — | |
| SCHEMBL10853116 | 0.71 | — | — | |
| Bromide SCHEMBL262065 | 0.69 | EHMT2 (0.33) | — | |
| Fluoride Ion SCHEMBL4607229 | 0.69 | EHMT2 (0.33) | — |
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-1711458-B1 | METHOD FOR PRODUCING GUANIDINIUM SALTS | MERCK PATENT GMBH (DE) | 2013-05-29 | — | — | EP | disclosed |
| US-7709158-B1 | Guanidine derivatives as cations for ambient temperature molten sales in electrochemical power sources | ELECTROCHEM SOLUTIONS, INC. (US) | 2010-05-04 | — | — | US | disclosed |
| US-7439395-B2 | Process for the preparation of guanidinium salts | MERCK PATENT GMBH (DE) | 2008-10-21 | — | — | US | disclosed |
| US-7439395-B2 | Process for the preparation of guanidinium salts | MERCK PATENT GMBH (DE) | 2008-10-21 | — | — | US | disclosed |
| US-20070135645-A1 | Process for the preparation of guanidinium salts | MERCK PATENT GMBH (DE) | 2007-06-14 | — | — | US | disclosed |
| US-20070135645-A1 | Process for the preparation of guanidinium salts | MERCK PATENT GMBH (DE) | 2007-06-14 | — | — | US | disclosed |
| EP-1711458-A1 | METHOD FOR PRODUCING GUANIDINIUM SALTS | MERCK PATENT GmbH (DE) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005075413-A1 | METHOD FOR PRODUCING GUANIDINIUM SALTS | MERCK PATENT GMBH (DE) | 2005-08-18 | — | — | WO | disclosed |
| EP-1363345-A2 | Guanidine derivatives as cations for ambient temperature molten salts in electrochemical power sources | Wilson Greatbatch Technologies, Inc. (US) | 2003-11-19 | — | — | EP | disclosed |
| US-20030211389-A1 | Guanidine derivatives as cations for ambient temperature molten salts in electrochemical power sources | GREATBATCH LTD. | 2003-11-13 | — | — | US | disclosed |