⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7713888 | 0.90 | — | — | |
| SCHEMBL7716170 | 0.89 | KDM4E (0.30) | — | |
| SCHEMBL7716165 | 0.83 | KDM4E (0.32) | — | |
| SCHEMBL7716145 | 0.83 | — | — | |
| SCHEMBL7715397 | 0.79 | KDM4E (0.33) | — | |
| SCHEMBL7718219 | 0.79 | — | — | |
| SCHEMBL7715396 | 0.77 | KDM4E (0.35) | — | |
| SCHEMBL28742067 | 0.77 | KDM4E (0.37) | — | |
| SCHEMBL3395142 | 0.75 | KDM4E (0.36) | — | |
| SCHEMBL14707437 | 0.74 | KDM4E (0.35) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6376632-B1 | NORBORNENE COMPOUND CONTAINING CARBOXY GROUPS | HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) | 2002-04-23 | — | — | US | disclosed |