⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19205274 | 0.75 | TDP2 (0.30) | — | |
| SCHEMBL2986851 | 0.67 | — | — | |
| SCHEMBL8186910 | 0.61 | APAF1 (0.32) | — | |
| SCHEMBL1187239 | 0.59 | TDP2 (0.39) | — | |
| SCHEMBL105350 | 0.56 | — | — | |
| Methane SCHEMBL28426734 | 0.55 | — | — | |
| SCHEMBL32689420 | 0.55 | TDP1 (0.39) | — | |
| SCHEMBL29366238 | 0.55 | — | — | |
| SCHEMBL2592408 | 0.55 | TDP1 (0.44) | — | |
| SCHEMBL103661 | 0.55 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100184952-A1 | METHOD FOR SELECTIVE REMOVAL OF DIBENZOFULVENE DERIVATIVE | AJINOMOTO CO., INC (JP) | 2010-07-22 | — | — | US | disclosed |
| EP-2181983-A1 | METHOD FOR SELECTIVE REMOVAL OF DIBENZOFULVENE DERIVATIVE | Ajinomoto Co., Inc. (JP) | 2010-05-05 | — | — | EP | disclosed |