⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL314705 | 0.79 | MAPT (0.50) | — | |
| SCHEMBL10530264 | 0.79 | TSHR (0.45) | — | |
| SCHEMBL10947092 | 0.78 | CA1 (0.44) | — | |
| SCHEMBL127000 | 0.77 | TSHR (0.65) | — | |
| SCHEMBL29637724 | 0.77 | TSHR (0.65) | — | |
| SCHEMBL22878 | 0.77 | TSHR (0.53) | — | |
| SCHEMBL29349760 | 0.77 | TSHR (0.53) | — | |
| Formaldehyde SCHEMBL9868053 | 0.76 | SMN1; SMN2 (0.58) | — | |
| SCHEMBL1146041 | 0.75 | ACHE (0.37) | — | |
| Phosphine SCHEMBL22634020 | 0.74 | TSHR (0.62) | — |
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 332 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10647687-B2 | Spiropyrazine derivatives as inhibitors of non-apoptotic regulated cell-death | HELMHOLTZ ZENTRUM MÜNCHEN DEUTSCHES FORSCHUNGSZENTRUM FÜR GESUNDHEIT UND UMWELT (GMBH) (DE) | 2020-05-12 | — | — | US | claimed |
| US-20180362475-A1 | SPIROPYRAZINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | HELMHOLTZ ZENTRUM MÜNCHEN DEUTSCHES FORSCHUNGSZENTRUM FÜR GESUNDHEIT UND UMWELT (GMBH) (DE) | 2018-12-20 | — | — | US | claimed |
| EP-3217982-A1 | SPIROPYRAZINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2017-09-20 | — | — | EP | claimed |
| WO-2016075137-A1 | SPIROPYRAZINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2016-05-19 | — | — | WO | claimed |
| US-20090233926-A1 | 2-BENZIMIDAZOLYL-6-MORPHOLINO-4-PIPERIDIN-4-YLPYRIMIDINE DERIVATIVES AS PI3K AND MTOR INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA (SE) | 2009-09-17 | — | — | US | claimed |
| EP-2064203-A1 | 2-BENZIMIDAZ0LYL-6-M0RPH0LIN0-4-PIPERIDIN-4-YLPYRIMIDINE DERIVATIVES AS PI3K AND MTOR INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | AstraZeneca AB (SE) | 2009-06-03 | — | — | EP | claimed |
| WO-2008032072-A1 | 2-BENZIMIDAZ0LYL-6-M0RPH0LIN0-4-PIPERIDIN-4-YLPYRIMIDINE DERIVATIVES AS PI3K AND MTOR INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2008-03-20 | — | — | WO | claimed |
| WO-2008032091-A1 | 4-BENZIMIDAZ0LYL-6-M0RPH0LIN0-2-PIPERIDIN-4-YLPYRIMIDINE DERIVATIVES AS PI3K AND MTOR INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2008-03-20 | — | — | WO | claimed |
| WO-2008032089-A1 | 4-BENZIMIDAZ0LYL-2-M0RPH0LIN0-6-PIPERIDIN-4-YLPYRIMIDINE DERIVATIVES AS PI3K AND MTOR INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2008-03-20 | — | — | WO | claimed |
| US-20070293496-A1 | Nitrogen containing heterocyclic compounds and medicines containing the same | OZAKI FUMIHIRO | 2007-12-20 | — | — | US | claimed |
| CN-1268025-A | Fungicidal combinations comprising phenylacrylic acid derivatives | NOVARTIS AG (CH) | 2000-09-27 | — | — | CN | claimed |
| EP-1035773-A1 | FUNGICIDAL COMBINATIONS COMPRISING THIENO 2,3-d]PYRIMIDIN-4-ONE | Novartis AG (CH) | 2000-09-20 | — | — | EP | claimed |
| EP-1006795-A1 | FUNGICIDAL COMBINATIONS COMPRISING PHENYLACRYLIC ACID DERIVATIVES | Novartis AG (CH) | 2000-06-14 | — | — | EP | claimed |
| WO-2000027200-A1 | FUNGICIDAL COMBINATIONS COMPRISING THIENO[2,3-d]PYRIMIDIN-4-ONE | SYNGENTA PARTICIPATIONS AG (CH) | 2000-05-18 | — | — | WO | claimed |
| WO-1999027790-A1 | FUNGICIDAL COMBINATIONS COMPRISING THIENO[2,3-d]PYRIMIDIN-4-ONE | NOVARTIS AG (CH) | 1999-06-10 | — | — | WO | claimed |
| EP-0741693-B1 | PROCESS FOR THE PREPARATION OF ARYLACETIC ESTER DERIVATIVES VIA PALLADIUM-CATALYZED CROSS COUPLING REACTION | NOVARTIS AG (CH) | 1999-03-24 | — | — | EP | claimed |
| WO-1999011125-A1 | FUNGICIDAL COMBINATIONS COMPRISING PHENYLACRYLIC ACID DERIVATIVES | NOVARTIS AG (CH) | 1999-03-11 | — | — | WO | claimed |
| US-5726343-A | REACTION OF A BORONIC ACID COMPOUND WITH A METHOXYIMINOACETIC ESTER, INSECTICIDES, MICROBIOCIDES | NOVARTIS CORPORATION (US) | 1998-03-10 | — | — | US | claimed |
| EP-0741693-A1 | PROCESS FOR THE PREPARATION OF ARYLACETIC ESTER DERIVATIVES VIA PALLADIUM-CATALYZED CROSS COUPLING REACTION | Novartis AG (CH) | 1996-11-13 | — | — | EP | claimed |
| WO-1995020569-A1 | PROCESS FOR THE PREPARATION OF ARYLACETIC ESTER DERIVATIVES VIA PALLADIUM-CATALYZED CROSS COUPLING REACTION | CIBA-GEIGY AG (CH) | 1995-08-03 | — | — | WO | claimed |