⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1994053 | 0.71 | — | — | |
| SCHEMBL9137525 | 0.58 | — | — | |
| SCHEMBL11806327 | 0.55 | — | — | |
| SCHEMBL9710961 | 0.55 | CTSL (0.32) | — | |
| SCHEMBL2042363 | 0.54 | — | — | |
| SCHEMBL24514891 | 0.53 | — | — | |
| SCHEMBL10578679 | 0.51 | — | — | |
| SCHEMBL2225499 | 0.50 | — | — | |
| SCHEMBL20439663 | 0.49 | — | — | |
| SCHEMBL3124122 | 0.49 | — | — |
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-7307173-B1 | Pyrroline chromophores | UNIVERSITY OF WASHINGTON (US) | 2007-12-11 | — | — | US | disclosed |