⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6979192 | 1.00 | — | — | |
| SCHEMBL8503437 | 0.88 | — | — | |
| SCHEMBL7581135 | 0.88 | — | — | |
| SCHEMBL7680321 | 0.85 | — | — | |
| SCHEMBL7680327 | 0.85 | — | — | |
| SCHEMBL8505944 | 0.82 | DRD4 (0.34) | — | |
| SCHEMBL6763775 | 0.82 | LMNA (0.34) | — | |
| SCHEMBL3364797 | 0.82 | LMNA (0.34) | — | |
| SCHEMBL1457093 | 0.82 | LMNA (0.34) | — | |
| SCHEMBL30915237 | 0.82 | LMNA (0.34) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101790583-A | Method for detecting binding between MDM2 and proteasome | JANSSEN PHARMACEUTICA NV | 2010-07-28 | — | — | CN | disclosed |
| CN-1803798-B | Method for producing fungicide compand | BAYER AG | 2010-06-16 | — | — | CN | disclosed |
| CN-1803798-A | Method for producing fungicide compand | BAYER AG (DE) | 2006-07-19 | — | — | CN | disclosed |
| US-20030125325-A1 | Pyrazolyl benzyl thioethers | BAYER AKTIENGESELLSCHAFT (DE) | 2003-07-03 | — | — | US | disclosed |
| US-20030109702-A1 | Fungicides, bactericides | BAYER AKTIENGESELLSCHAFT (DE) | 2003-06-12 | — | — | US | disclosed |
| US-6420362-B1 | Azines containing the 5,6-di-hydro-(1,4,2) dioxazine-3-yl group and the use thereof as fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 2002-07-16 | — | — | US | disclosed |
| EP-1172362-A1 | Azadioxacycloalkenes and their use as fungicides and animal pesticides | BASF AKTIENGESELLSCHAFT (DE) | 2002-01-16 | — | — | EP | disclosed |
| US-6271226-B1 | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2001-08-07 | — | — | US | disclosed |
| US-6221862-B1 | Microbicide 1,4,2-dioxazine derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 2001-04-24 | — | — | US | disclosed |
| CN-1057762-C | Substituted azadioxacycloalkenes and their use as fungicides | BAYER AG (DE) | 2000-10-25 | — | — | CN | disclosed |
| CN-1222301-A | Process for preparing fungicidal compositions | BAYER AG (DE) | 1999-07-14 | — | — | CN | disclosed |
| EP-0712396-B1 | SUBSTITUTED AZADIOXACYCLOALKENES AND THEIR USE AS FUNGICIDES | BAYER AG (DE) | 1998-11-04 | — | — | EP | disclosed |
| CN-1132507-A | Substituted diazadioxacycloalkenes and their use as fungicides | BAYER AG (DE) | 1996-10-02 | — | — | CN | disclosed |