⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL515670 | 0.59 | — | — | |
| SCHEMBL10033295 | 0.59 | — | — | |
| SCHEMBL868176 | 0.58 | — | — | |
| SCHEMBL21183151 | 0.58 | — | — | |
| SCHEMBL13958436 | 0.57 | — | — | |
| SCHEMBL10899120 | 0.55 | — | — | |
| SCHEMBL10099731 | 0.55 | — | — | |
| SCHEMBL12212382 | 0.52 | — | — | |
| SCHEMBL16748840 | 0.51 | — | — | |
| SCHEMBL12656516 | 0.51 | — | — |
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-5552508-A | Difunctional bitricyclodecatriene monomers | UNIVERSITY OF MICHIGAN, THE BOARD OF REGENTS (US) | 1996-09-03 | — | — | US | disclosed |