⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10793222 | 1.00 | — | — | |
| SCHEMBL785169 | 0.94 | — | — | |
| SCHEMBL22284113 | 0.94 | ALDH1A1 (1.00) | — | |
| SCHEMBL28667 | 0.94 | — | — | |
| SCHEMBL11571669 | 0.89 | — | — | |
| SCHEMBL11320004 | 0.89 | ALDH1A1 (0.89) | — | |
| SCHEMBL11573984 | 0.89 | ALDH1A1 (0.89) | — | |
| SCHEMBL11573979 | 0.89 | ALDH1A1 (0.89) | — | |
| Acrylonitrile SCHEMBL11784382 | 0.77 | ALDH1A1 (0.75) | — | |
| Acrylonitrile SCHEMBL11784384 | 0.77 | ALDH1A1 (0.75) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130004861-A1 | ELECTROLYTE ADDITIVE FOR LITHIUM SECONDARY BATTERY, NON-AQUEOUS ELECTROLYTE, AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME | SAMSUNG SDI CO., LTD. (KR) | 2013-01-03 | — | — | US | claimed |
| CN-1035874-C | Preparation of 1-amino-1-cyanamido-2,2-dicyanoethylene, sodium salt abstract of the disclosure | CIBA GEIGY (CH) | 1997-09-17 | — | — | CN | claimed |
| CN-1107465-A | Preparation of 1-amino-1-cyanamido-2,2-dicyanoethylene, sodium salt abstract of the disclosure | CIBA GEIGY AG (CH) | 1995-08-30 | — | — | CN | claimed |
| US-20130004861-A1 | ELECTROLYTE ADDITIVE FOR LITHIUM SECONDARY BATTERY, NON-AQUEOUS ELECTROLYTE, AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME | SAMSUNG SDI CO., LTD. (KR) | 2013-01-03 | — | — | US | disclosed |
| CN-102399193-A | Preparation method of 4, 6-diamino-2-cyclopropylamino-5-cyanopyrimidine | LIANYUNGANG YAHUI MEDICAL CHEMICAL CO LTD | 2012-04-04 | — | — | CN | disclosed |
| CN-1035874-C | Preparation of 1-amino-1-cyanamido-2,2-dicyanoethylene, sodium salt abstract of the disclosure | CIBA GEIGY (CH) | 1997-09-17 | — | — | CN | disclosed |
| CN-1128024-A | Process for preparing substituted 4, 6-diamino-5-cyanopyrimidines | CIBA GEIGY AG (CH) | 1996-07-31 | — | — | CN | disclosed |
| CN-1107465-A | Preparation of 1-amino-1-cyanamido-2,2-dicyanoethylene, sodium salt abstract of the disclosure | CIBA GEIGY AG (CH) | 1995-08-30 | — | — | CN | disclosed |
| EP-0258655-A2 | Complexes of platinum (II) 2,3-dinitrilo-2-butene-2,3-dithiolate, a process for preparing them and pharmaceutical compositions containing them | FERRER INTERNACIONAL, S.A. (ES) | 1988-03-09 | — | — | EP | disclosed |