⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10311682 | 0.85 | ADRA2C (0.30) | — | |
| SCHEMBL12250053 | 0.71 | — | — | |
| SCHEMBL20625884 | 0.71 | — | — | |
| SCHEMBL13448389 | 0.71 | — | — | |
| SCHEMBL14564574 | 0.71 | — | — | |
| SCHEMBL19770696 | 0.71 | ADRA2C (0.32) | — | |
| SCHEMBL19711790 | 0.71 | ADRA2C (0.32) | — | |
| SCHEMBL19091628 | 0.70 | — | — | |
| SCHEMBL19337484 | 0.70 | — | — | |
| SCHEMBL10311254 | 0.64 | — | — |
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-10174255-B2 | Thermosetting composition with photo-alignment property, alignment layer, substrate with alignment layer, retardation plate, and device | DAI NIPPON PRINTING CO., LTD. (JP) | 2019-01-08 | — | — | US | disclosed |