⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28028364 | 0.81 | GPR84 (0.48) | — | |
| SCHEMBL5907150 | 0.78 | KDM4E (0.48) | — | |
| SCHEMBL3456199 | 0.78 | — | — | |
| SCHEMBL758590 | 0.76 | — | — | |
| SCHEMBL3004179 | 0.76 | — | — | |
| SCHEMBL3020665 | 0.76 | — | — | |
| SCHEMBL135974 | 0.76 | — | — | |
| SCHEMBL12020546 | 0.76 | — | — | |
| SCHEMBL10513780 | 0.74 | HSD17B10 (0.61) | — | |
| SCHEMBL8016289 | 0.74 | HSD17B10 (0.61) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8361442-B2 | Oxime conjugates and methods for their formation and use | THE GENERAL HOSPITAL CORPORATION (US) | 2013-01-29 | — | — | US | disclosed |
| US-20120027680-A1 | OXIME CONJUGATES AND METHODS FOR THEIR FORMATION AND USE | THE GENERAL HOSPITAL CORPORATION (US) | 2012-02-02 | — | — | US | disclosed |
| US-8030459-B2 | Oxime conjugates and methods for their formation and use | THE GENERAL HOSPITAL CORPORATION (US) | 2011-10-04 | — | — | US | disclosed |