⚠ 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 | |
|---|---|---|---|---|
| N,N-Dimethylethanaminium SCHEMBL1352352 | 1.00 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL28663241 | 0.95 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL28212428 | 0.95 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL28212427 | 0.95 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL16338 | 0.94 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL352062 | 0.94 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL2146567 | 0.94 | TSHR (0.36) | — | |
| N,N-Dimethylethanaminium SCHEMBL321085 | 0.89 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL6577702 | 0.89 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL672490 | 0.89 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8012458-B2 | Rare-earth amidate coordination compounds | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-09-06 | — | — | US | disclosed |
| US-20080305309-A1 | COATING COMPOSITIONS, PROCESS AND LUMINESCENT COATED ARTICLES | E. I. DU PONT DE NEMOURS AND COMPANY | 2008-12-11 | — | — | US | disclosed |
| US-20080306251-A1 | RARE-EARTH AMIDATE COORDINATION COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY | 2008-12-11 | — | — | US | disclosed |
| US-20080305243-A1 | METHOD FOR IDENTIFYING ARTICLES AND PROCESS FOR MAINTAINING SECURITY | E. I. DU PONT DE NEMOURS AND COMPANY | 2008-12-11 | — | — | US | disclosed |
| US-20080306250-A1 | RARE-EARTH AMIDATE CHELATES | E. I. DU PONT DE NEMOURS AND COMPANY | 2008-12-11 | — | — | US | disclosed |