⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4577818 | 0.85 | — | — | |
| SCHEMBL6897221 | 0.83 | NPC1 (0.30) | — | |
| SCHEMBL5080292 | 0.83 | LMNA (0.31) | — | |
| SCHEMBL16338957 | 0.80 | — | — | |
| SCHEMBL16339193 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL17698574 | 0.78 | HTR7 (0.30) | — | |
| SCHEMBL4577452 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL8383390 | 0.72 | — | — | |
| SCHEMBL5080295 | 0.71 | — | — | |
| SCHEMBL4577780 | 0.70 | LMNA (0.31) | — |
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-8927671-B2 | Ethylene-α-olefin copolymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-01-06 | — | — | US | disclosed |