⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17582512 | 1.00 | — | — | |
| SCHEMBL17582513 | 1.00 | — | — | |
| SCHEMBL20204315 | 0.81 | KDM4E (0.33) | — | |
| SCHEMBL16317445 | 0.78 | SIRT2 (0.36) | — | |
| SCHEMBL17582524 | 0.78 | SIRT2 (0.36) | — | |
| SCHEMBL16193210 | 0.78 | SIRT2 (0.36) | — | |
| SCHEMBL17582516 | 0.76 | LMNA (0.33) | — | |
| SCHEMBL9758838 | 0.76 | SIRT2 (0.42) | — | |
| SCHEMBL16193271 | 0.76 | LMNA (0.33) | — | |
| SCHEMBL16179651 | 0.76 | KDM4E (0.45) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9636670-B2 | Catalysts, ligands and use thereof | OXFORD UNIVERSITY INNOVATION LIMITED (GB) | 2017-05-02 | — | — | US | disclosed |
| US-9636670-B2 | Catalysts, ligands and use thereof | OXFORD UNIVERSITY INNOVATION LIMITED (GB) | 2017-05-02 | — | — | US | disclosed |
| US-20160074852-A1 | CATALYSTS, LIGANDS AND USE THEREOF | ISIS INNOVATION LIMITED (GB) | 2016-03-17 | — | — | US | disclosed |
| WO-2014170642-A2 | CATALYSTS, LIGANDS AND USE THEREOF | ISIS INNOVATION LIMITED (GB) | 2014-10-23 | — | — | WO | disclosed |