⚠ 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL152452 | 0.82 | — | — | |
| SCHEMBL167833 | 0.82 | — | — | |
| SCHEMBL4432240 | 0.82 | — | — | |
| SCHEMBL82 | 0.82 | — | — | |
| SCHEMBL3128058 | 0.82 | — | — | |
| SCHEMBL5517182 | 0.82 | CA5A (0.56) | — | |
| Chloroform SCHEMBL5603410 | 0.78 | — | — | |
| Sulfuric Acid SCHEMBL20641565 | 0.78 | CA5A (0.55) | — | |
| Sulfuric Acid SCHEMBL9568493 | 0.78 | CA5A (0.55) | — | |
| Sulfuric Acid SCHEMBL408154 | 0.78 | CA5A (0.55) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1087967-B1 | 1,3-OXAZOLINE AND 1,3-THIAZOLINE DERIVATIVES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS PESTICIDES | BAYER CROPSCIENCE GMBH (DE) | 2003-10-22 | — | — | EP | disclosed |
| EP-1087967-A1 | 1,3-OXAZOLINE AND 1,3-THIAZOLINE DERIVATIVES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS PESTICIDES | Aventis CropScience GmbH (DE) | 2001-04-04 | — | — | EP | disclosed |
| EP-0557787-B1 | Imidazolylphenol derivatives, medicaments containing them and a process for the preparation of these compounds and medicaments | GRUENENTHAL GMBH (DE) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999065901-A1 | 1,3-OXAZOLINE AND 1,3-THIAZOLINE DERIVATIVES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS PESTICIDES | AVENTIS CROPSCIENCE GMBH (DE) | 1999-12-23 | — | — | WO | disclosed |
| WO-1999024409-A1 | ISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES | NOVARTIS AG (CH) | 1999-05-20 | — | — | WO | disclosed |
| EP-0797612-B1 | METHOD FOR PREPARING ESSENTIALLY CYCLENE-FREE POLYORGANOSILOXANES AND ORGANOFUNCTIONAL SILOXANES | HUELS SILICONE GMBH (DE) | 1999-01-13 | — | — | EP | disclosed |
| EP-0797612-A1 | METHOD FOR PREPARING ESSENTIALLY CYCLENE-FREE POLYORGANOSILOXANES AND ORGANOFUNCTIONAL SILOXANES | Hüls Silicone Gesellschaft mit beschränkter Haftung (DE) | 1997-10-01 | — | — | EP | disclosed |
| WO-1996018670-A1 | METHOD FOR PREPARING ESSENTIALLY CYCLENE-FREE POLYORGANOSILOXANES AND ORGANOFUNCTIONAL SILOXANES | HÜLS SILICONE GMBH (DE) | 1996-06-20 | — | — | WO | disclosed |
| EP-0525516-B1 | Derivatives of beta substituted cinnomic acid | BASF AG (DE) | 1995-09-27 | — | — | EP | disclosed |
| EP-0557787-A1 | Imidazolylphenol derivatives, medicaments containing them and a process for the preparation of these compounds and medicaments | Grünenthal GmbH (DE) | 1993-09-01 | — | — | EP | disclosed |
| EP-0525516-A2 | Derivatives of beta substituted cinnomic acid | BASF Aktiengesellschaft (DE) | 1993-02-03 | — | — | EP | disclosed |
| EP-0165448-B1 | 1-HETEROARYL-4-ARYL-PYRAZOLIN-5-ONES | BAYER AG (DE) | 1991-10-16 | — | — | EP | disclosed |
| EP-0310954-B1 | ORTHO-SUBSTITUTED CARBOXYLIC ACID BENZYL ESTERS AND FUNGICIDES CONTAINING THESE COMPOUNDS | BASF Aktiengesellschaft (DE) | 1990-11-22 | — | — | EP | disclosed |
| EP-0336211-B1 | ORTHO-SUBSTITUTED PHENOL ETHERS AND FUNGICIDES CONTAINING THEM | BASF Aktiengesellschaft (DE) | 1990-11-07 | — | — | EP | disclosed |
| EP-0336211-A1 | Ortho-substituted phenol ethers and fungicides containing them | BASF Aktiengesellschaft (DE) | 1989-10-11 | — | — | EP | disclosed |
| EP-0310954-A1 | Ortho-substituted carboxylic acid benzyl esters and fungicides containing these compounds | BASF Aktiengesellschaft (DE) | 1989-04-12 | — | — | EP | disclosed |
| EP-0183159-A2 | 1-Heteroaryl-4-aryl-pyrazolin-5-ones for use as medicaments | BAYER AG (DE) | 1986-06-04 | — | — | EP | disclosed |
| EP-0165448-A2 | 1-Heteroaryl-4-aryl-pyrazolin-5-ones | BAYER AG (DE) | 1985-12-27 | — | — | EP | disclosed |
| EP-0010249-A2 | Herbicidal agents, process for their preparation and their use in combating weeds | BAYER AG (DE) | 1980-04-30 | — | — | EP | disclosed |