⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5752999 | 0.67 | — | — | |
| SCHEMBL2357812 | 0.67 | — | — | |
| SCHEMBL220563 | 0.67 | — | — | |
| SCHEMBL9048951 | 0.64 | DYRK1A (0.34) | — | |
| Benzodiazepine SCHEMBL7160172 | 0.59 | GAA (0.44) | — | |
| SCHEMBL788951 | 0.59 | — | — | |
| SCHEMBL1395961 | 0.58 | — | — | |
| SCHEMBL1395959 | 0.58 | — | — | |
| SCHEMBL29883304 | 0.58 | — | — | |
| Benzodiazepine SCHEMBL936208 | 0.58 | GAA (0.43) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3071560-B1 | N-ACYLIMINO HETEROCYCLIC COMPOUNDS | BASF SE (DE) | 2018-01-10 | — | — | EP | disclosed |
| US-9783523-B2 | N-acylimino heterocyclic compounds | BASF SE (DE) | 2017-10-10 | — | — | US | disclosed |
| US-20160326153-A1 | N-SUBSTITUTED IMINO HETEROCYCLIC COMPOUNDS | BASF SE (DE) | 2016-11-10 | — | — | US | disclosed |
| EP-3083581-A1 | N-SUBSTITUTED IMINO HETEROCYCLIC COMPOUNDS | BASF SE (DE) | 2016-10-26 | — | — | EP | disclosed |
| US-20160297793-A1 | N-ACYLIMINO HETEROCYCLIC COMPOUNDS | BASF SE (DE) | 2016-10-13 | — | — | US | disclosed |
| CN-106029645-A | N-substituted imino heterocyclic compounds | 巴斯夫欧洲公司 | 2016-10-12 | — | — | CN | disclosed |
| EP-3071560-A1 | N-ACYLIMINO HETEROCYCLIC COMPOUNDS | BASF SE (DE) | 2016-09-28 | — | — | EP | disclosed |
| WO-2015091649-A1 | N-SUBSTITUTED IMINO HETEROCYCLIC COMPOUNDS | BASF SE (DE) | 2015-06-25 | — | — | WO | disclosed |
| WO-2015075174-A1 | N-ACYLIMINO HETEROCYCLIC COMPOUNDS | BASF SE (DE) | 2015-05-28 | — | — | WO | disclosed |