⚠ 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 | |
|---|---|---|---|---|
| Phosphoramidic Acid SCHEMBL15067660 | 1.00 | CA2 (0.42) | — | |
| Phosphoramidic Acid SCHEMBL28118276 | 1.00 | — | — | |
| Phosphoramidic Acid SCHEMBL9224887 | 1.00 | — | — | |
| Phosphoramidic Acid SCHEMBL28135205 | 0.94 | CA2 (0.46) | — | |
| Phosphoramidic Acid SCHEMBL30498012 | 0.94 | CA2 (0.46) | — | |
| Phosphoramidic Acid SCHEMBL25846 | 0.94 | — | — | |
| Phosphoramidic Acid SCHEMBL17076496 | 0.89 | — | — | |
| Phosphoramidic Acid SCHEMBL7136498 | 0.89 | — | — | |
| Phosphoramidic Acid SCHEMBL21646133 | 0.89 | — | — | |
| Phosphoramidic Acid SCHEMBL615713 | 0.89 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109134380-A | Chloro aminooimidazole class compound and preparation method thereof, purposes and detection method | 上海慈瑞医药科技股份有限公司 | 2019-01-04 | — | — | CN | claimed |
| CN-109134380-A | Chloro aminooimidazole class compound and preparation method thereof, purposes and detection method | 上海慈瑞医药科技股份有限公司 | 2019-01-04 | — | — | CN | disclosed |
| CN-101668767-A | Pyridine derivatives substituted with heterocyclic ring and phosphonoamino group and antifungal agent containing the same | EISAI R&D MAN CO LTD | 2010-03-10 | — | — | CN | disclosed |
| US-7348315-B2 | Methods of treating heart failure with modified ATP, ADP and AMP compounds | THE UNIVERSITY OF CONNECTICUT (US) | 2008-03-25 | — | — | US | disclosed |
| US-20030186929-A1 | Methods of treating heart failure with modified ATP, ADP and AMP compounds | NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR | 2003-10-02 | — | — | US | disclosed |
| US-6255292-B1 | INCREASING CELLULAR CONTRACTIONS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2001-07-03 | — | — | US | disclosed |
| WO-1996029345-A1 | NOVEL INOTROPIC AGENTS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1996-09-26 | — | — | WO | disclosed |