⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15200783 | 0.68 | — | — | |
| SCHEMBL5729041 | 0.66 | — | — | |
| SCHEMBL4698483 | 0.63 | — | — | |
| SCHEMBL28704840 | 0.62 | — | — | |
| SCHEMBL28045655 | 0.62 | — | — | |
| SCHEMBL27631378 | 0.61 | PARP10 (0.55) | — | |
| Trifluoroacetic Acid SCHEMBL28045656 | 0.61 | L3MBTL1 (0.33) | — | |
| SCHEMBL2067207 | 0.61 | — | — | |
| SCHEMBL9083997 | 0.59 | CES1 (0.32) | — | |
| SCHEMBL28756727 | 0.58 | MAP2K1 (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 |
|---|---|---|---|---|---|---|---|
| EP-2900674-A1 | COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH | University of Washington through its Center for Commercialization (US) | 2015-08-05 | — | — | EP | disclosed |