⚠ 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 | |
|---|---|---|---|---|
| Anisole SCHEMBL14954292 | 0.97 | CA4 (0.88) | — | |
| Anisole SCHEMBL14954343 | 0.97 | CA4 (0.88) | — | |
| Anisole SCHEMBL14954116 | 0.97 | CA4 (0.88) | — | |
| Anisole SCHEMBL14953804 | 0.97 | CA4 (0.88) | — | |
| Anisole SCHEMBL30601749 | 0.97 | — | — | |
| Anisole SCHEMBL8472521 | 0.97 | CA4 (1.00) | — | |
| Anisole SCHEMBL28813915 | 0.97 | CA4 (1.00) | — | |
| Anisole SCHEMBL10721106 | 0.97 | CA4 (1.00) | — | |
| Anisole SCHEMBL20328417 | 0.97 | — | — | |
| Anisole SCHEMBL1205 | 0.97 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8722912-B2 | Metal complex compound and process for producing amides utilizing the metal complex compound | NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) | 2014-05-13 | — | — | US | disclosed |
| US-20130131366-A1 | Metal Complex Compound and Process for Producing Amides Utilizing the Metal Complex Compound | NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) | 2013-05-23 | — | — | US | disclosed |