⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL920855 | 0.95 | CYP1A2 (0.41) | — | |
| SCHEMBL921655 | 0.93 | SIGMAR1 (0.39) | — | |
| SCHEMBL303718 | 0.93 | CYP1A2 (0.44) | — | |
| SCHEMBL10444597 | 0.91 | SIGMAR1 (0.42) | — | |
| SCHEMBL7055348 | 0.91 | SIGMAR1 (0.42) | — | |
| SCHEMBL919513 | 0.90 | — | — | |
| SCHEMBL6380675 | 0.88 | SIGMAR1 (0.43) | — | |
| SCHEMBL7054446 | 0.86 | SIGMAR1 (0.46) | — | |
| SCHEMBL3326401 | 0.86 | SIGMAR1 (0.46) | — | |
| SCHEMBL919602 | 0.84 | — | — |
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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9630928-B2 | Intermediates to prepare herbicidal pyrimidone derivatives | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2017-04-25 | — | — | US | disclosed |
| EP-2475654-B1 | HERBICIDAL PYRIMIDONE DERIVATIVES | DU PONT (US) | 2016-12-28 | — | — | EP | disclosed |
| US-20160024020-A1 | INTERMEDIATES TO PREPARE HERBICIDAL PYRIMIDONE DERIVATIVES | FMC CORPORATION | 2016-01-28 | — | — | US | disclosed |
| US-9187432-B2 | Intermediates to prepare herbicidal pyrimidone derivatives | E I DU PONT DE NEMOURS AND COMPANY (US) | 2015-11-17 | — | — | US | disclosed |
| US-20150105549-A1 | INTERMEDIATES TO PREPARE HERBICIDAL PYRIMIDONE DERIVATIVES | FMC CORPORATION | 2015-04-16 | — | — | US | disclosed |
| US-8952024-B2 | Herbicidal pyrimidone derivatives | E I DU PONT DE NEMOURS AND COMPANY (US) | 2015-02-10 | — | — | US | disclosed |
| WO-2014031971-A1 | HERBICIDAL PYRIDAZINONES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2014-02-27 | — | — | WO | disclosed |
| US-20140024527-A1 | HERBICIDAL PYRAZINONES | E I DU DE NEMOURS AND COMPANY (US) | 2014-01-23 | — | — | US | disclosed |
| US-8349870-B2 | Fungicidal hetercyclic compounds | E I DU PONT DE NEMOURS AND COMPANY (US) | 2013-01-08 | — | — | US | disclosed |
| WO-2012148622-A1 | HERBICIDAL PYRAZINONES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-11-01 | — | — | WO | disclosed |
| US-20050215798-A1 | Method for preparing 3-halo-4,5-dihydro-1h-pyrazoles | FMC CORPORATION | 2005-09-29 | — | — | US | disclosed |
| EP-1549643-A2 | METHOD FOR PREPARING FUSED OXAZINONES FROM ORTHO-AMINO AROMATIC CARBOXYLIC ACID AND A CARBOXYLIC ACID IN THE PRESENCE OF A SULFONYL CHLORIDE AND PYRIDINE | E.I. du Pont de Nemours and Company (US) | 2005-07-06 | — | — | EP | disclosed |
| EP-1537097-A2 | METHOD FOR PREPARING 3-HALO-4,5-DIHYDRO-1 I H /I -PYRAZOLES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004111030-A1 | METHOD FOR PREPARING FUSED OXAZINONES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2004-12-23 | — | — | WO | disclosed |
| WO-2004087689-A1 | PREPARATION AND USE OF 2-SUBSTITUTED-5-OXO-3- PYRAZOLIDINECARBOXYLATES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2004-10-14 | — | — | WO | disclosed |
| WO-2004011453-A2 | METHOD FOR PREPARING 3-HALO-4,5-DIHYDRO-1H-PYRAZOLES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2004-02-05 | — | — | WO | disclosed |
| WO-2004011447-A2 | METHOD FOR PREPARING FUSED OXAZINONES FROM ORTHO-AMINO AROMATIC CARBOXYLIC ACID AND A CARBOXYLIC ACID IN THE PRESENCE OF A SULFONYL CHLORIDE AND PYRIDINE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2004-02-05 | — | — | WO | disclosed |
| EP-0994108-B1 | PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES | ZERIA PHARM CO LTD (JP) | 2003-05-14 | — | — | EP | disclosed |
| US-6197970-B1 | REACTING WITH SECONDARY OR TERTIARY AMINE; DEBLOCKING, DEPROTECTING | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 2001-03-06 | — | — | US | disclosed |
| EP-0994108-A1 | PROCESS FOR PRODUCING 2-HYDROXYBENZAMIDE DERIVATIVES | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-19 | — | — | EP | disclosed |