⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7945324 | 0.88 | CA12 (0.32) | — | |
| SCHEMBL11250098 | 0.80 | TSHR (0.33) | — | |
| SCHEMBL11168811 | 0.79 | TSHR (0.36) | — | |
| SCHEMBL9440098 | 0.78 | — | — | |
| SCHEMBL9367808 | 0.78 | TSHR (0.36) | — | |
| SCHEMBL9614406 | 0.77 | — | — | |
| SCHEMBL11203654 | 0.75 | HTR7 (0.34) | — | |
| SCHEMBL28706950 | 0.74 | CA12 (0.31) | — | |
| SCHEMBL5648885 | 0.74 | — | — | |
| SCHEMBL9249642 | 0.73 | TSHR (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0472564-A1 | ARYLESTERS OF PHOSPHONOUS ACID, PROCESS FOR PREPARING THEM AND THEIR USE TO STABILIZE PLASTICS, IN PARTICULAR POLYOLEFIN MOULDING MATERIALS. | HOECHST AG (DE) | 1992-03-04 | — | — | EP | disclosed |
| EP-0402889-A2 | Polymeric polyalkyl-1-oxadiazaspirodecanes | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-12-19 | — | — | EP | disclosed |
| WO-1990014349-A2 | ARYLESTERS OF PHOSPHONOUS ACID, PROCESS FOR PREPARING THEM AND THEIR USE TO STABILIZE PLASTICS, IN PARTICULAR POLYOLEFIN MOULDING MATERIALS | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-11-29 | — | — | WO | disclosed |