⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL37027 | 0.67 | — | — | |
| SCHEMBL639752 | 0.61 | — | — | |
| SCHEMBL3240165 | 0.58 | — | — | |
| SCHEMBL12285721 | 0.58 | — | — | |
| SCHEMBL5557185 | 0.55 | — | — | |
| SCHEMBL4515236 | 0.55 | — | — | |
| Water SCHEMBL277569 | 0.55 | — | — | |
| Hydrogen Sulfide SCHEMBL11679956 | 0.55 | — | — | |
| SCHEMBL1056772 | 0.55 | — | — | |
| SCHEMBL144636 | 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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5883250-A | ARYL SUBSTITUTED COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1999-03-16 | — | — | US | claimed |
| US-5852013-A | Substituted arylazadioxacyclo alkene fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1998-12-22 | — | — | US | claimed |
| EP-0712396-B1 | SUBSTITUTED AZADIOXACYCLOALKENES AND THEIR USE AS FUNGICIDES | BAYER AG (DE) | 1998-11-04 | — | — | EP | claimed |
| US-5679676-A | Substituted azadioxacycloalkenes and their use as fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1997-10-21 | — | — | US | claimed |
| US-6407098-B1 | 3-(CARBOXIMINO)-1,4,2-OXATHIAZINE DERIVATIVES; PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-18 | — | — | US | disclosed |
| EP-0840721-B1 | CARBOXYLIC ACID AMIDE DERIVATIVES AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 2001-10-04 | — | — | EP | disclosed |
| US-6214825-B1 | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2001-04-10 | — | — | US | disclosed |
| US-6177459-B1 | WELL TOLERATED BY PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-01-23 | — | — | US | disclosed |
| US-5883250-A | ARYL SUBSTITUTED COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1999-03-16 | — | — | US | disclosed |
| US-5852013-A | Substituted arylazadioxacyclo alkene fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1998-12-22 | — | — | US | disclosed |
| CN-1193317-A | carboxylic acid amine derivatives and their use as pesticides | BAYER AG (DE) | 1998-09-16 | — | — | CN | disclosed |
| EP-0840721-A1 | CARBOXYLIC ACID AMIDE DERIVATIVES AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 1998-05-13 | — | — | EP | disclosed |
| US-5679676-A | Substituted azadioxacycloalkenes and their use as fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1997-10-21 | — | — | US | disclosed |
| WO-1997000856-A1 | CARBOXYLIC ACID AMIDE DERIVATIVES AND THEIR USE AS PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-01-09 | — | — | WO | disclosed |