⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8965480 | 0.89 | — | — | |
| SCHEMBL8965821 | 0.88 | — | — | |
| SCHEMBL8965511 | 0.84 | TSHR (0.33) | — | |
| SCHEMBL8966004 | 0.79 | — | — | |
| SCHEMBL18391698 | 0.76 | CES2 (0.34) | — | |
| SCHEMBL3154184 | 0.76 | — | — | |
| SCHEMBL1634078 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL8965873 | 0.75 | — | — | |
| SCHEMBL6141144 | 0.75 | HSD17B10 (0.30) | — | |
| SCHEMBL14299775 | 0.75 | HSD17B10 (0.30) | — |
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-5547762-A | THERMOSETTING RESIN LAYER | BRIDGESTONE CORPORATION (JP) | 1996-08-20 | — | — | US | disclosed |