⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5900933 | 0.77 | — | — | |
| SCHEMBL8140270 | 0.74 | — | — | |
| SCHEMBL6858013 | 0.70 | — | — | |
| SCHEMBL780441 | 0.69 | — | — | |
| SCHEMBL9311836 | 0.67 | — | — | |
| SCHEMBL690723 | 0.64 | — | — | |
| SCHEMBL27575648 | 0.63 | TSHR (0.39) | — | |
| SCHEMBL30250687 | 0.63 | — | — | |
| SCHEMBL17225094 | 0.63 | — | — | |
| SCHEMBL112 | 0.63 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000003580-A2 | UTILIZATION OF 3,3-DICHLORO-2-FLUORO-ACRYLIC ACID DERIVATIVES FOR PEST CONTROL | BAYER AKTIENGESELLSCHAFT (DE) | 2000-01-27 | — | — | WO | claimed |
| CN-1138856-A | Sabstituted oxazolines | BAYER AG (DE) | 1996-12-25 | — | — | CN | claimed |
| EP-1132368-B1 | Process for the preparation of 2-fluoro-1,1-dichloro-acrylyl chloride | BAYER CROPSCIENCE AG (DE) | 2003-11-12 | — | — | EP | disclosed |
| EP-0740660-B1 | SUBSTITUTED OXAZOLINES | BAYER AG (DE) | 2001-11-07 | — | — | EP | disclosed |
| EP-1132368-A2 | Process for the preparation of 2-fluoro-1,1-dichloro-acrylyl chloride | Bayer Aktiengesellschaft (DE) | 2001-09-12 | — | — | EP | disclosed |
| EP-1132368-A2 | Process for the preparation of 2-fluoro-1,1-dichloro-acrylyl chloride | Bayer Aktiengesellschaft (DE) | 2001-09-12 | — | — | EP | disclosed |
| EP-0726270-B1 | Derivatives of 1,6-naphthyridone carboxylic acids | BAYER AG (DE) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000003580-A2 | UTILIZATION OF 3,3-DICHLORO-2-FLUORO-ACRYLIC ACID DERIVATIVES FOR PEST CONTROL | BAYER AKTIENGESELLSCHAFT (DE) | 2000-01-27 | — | — | WO | disclosed |
| US-5990140-A | 2-ALKYL OR CYCLOALKYL-4-PHENYL-2-OXAZOLINE DERIVATIVES; PESTICIDES; INSECTICIDES; MITICIDES; LARVICIDES; LOW DOSAGE | BAYER AKTIENGESELLSCHAFT (DE) | 1999-11-23 | — | — | US | disclosed |
| US-5811433-A | ANTIMICROBIALS | BAYER AKTIENGESELLSCHAFT (DE) | 1998-09-22 | — | — | US | disclosed |
| CN-1138856-A | Sabstituted oxazolines | BAYER AG (DE) | 1996-12-25 | — | — | CN | disclosed |
| EP-0726270-A1 | Derivatives of 1,6-naphthyridine carboxylic acids | BAYER AG (DE) | 1996-08-14 | — | — | EP | disclosed |