⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8492209 | 0.81 | SCN10A (0.32) | — | |
| SCHEMBL3263187 | 0.77 | — | — | |
| SCHEMBL15513862 | 0.75 | CYP1A2 (0.32) | — | |
| SCHEMBL15755537 | 0.74 | GSK3B (0.45) | — | |
| SCHEMBL8727164 | 0.74 | — | — | |
| SCHEMBL7615261 | 0.73 | BLM (0.33) | — | |
| Phthalic Acid SCHEMBL28090264 | 0.73 | SLC7A5 (0.45) | — | |
| Histidine SCHEMBL28071765 | 0.72 | SLC7A5 (0.50) | — | |
| Histidine SCHEMBL28098393 | 0.72 | CYP1A2 (0.49) | — | |
| Histidine SCHEMBL7518990 | 0.72 | KDM4E (0.45) | — |
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-20110065838-A1 | Hydroxyphenyl Phosphine Oxide Mixtures and their use as Flame Retardants for Epoxy Resins | CHEMTURA CORPORATION (US) | 2011-03-17 | — | — | US | disclosed |