⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6567096 | 0.77 | — | — | |
| Methane SCHEMBL10769987 | 0.75 | TSHR (0.41) | — | |
| SCHEMBL28163786 | 0.75 | TSHR (0.41) | — | |
| SCHEMBL28171450 | 0.75 | TSHR (0.41) | — | |
| SCHEMBL1652590 | 0.74 | — | — | |
| SCHEMBL23903683 | 0.73 | ALDH1A1 (0.34) | — | |
| SCHEMBL19869376 | 0.73 | ALDH1A1 (0.41) | — | |
| SCHEMBL7168970 | 0.72 | ALDH1A1 (0.48) | — | |
| Ethylene SCHEMBL27457192 | 0.72 | HSD17B10 (0.50) | — | |
| Water SCHEMBL27989114 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6559241-B2 | Process for producing a hydrogenated polymer | KURARAY CO., LTD. (JP) | 2003-05-06 | — | — | US | disclosed |
| US-20020137854-A1 | Process for producing a hydrogenated polymer | KURARAY CO. LTD. (JP) | 2002-09-26 | — | — | US | disclosed |
| EP-1241189-A1 | Process for producing a hydrogenated polymer | KURARAY CO., LTD. (JP) | 2002-09-18 | — | — | EP | disclosed |
| US-5155240-A | Process for producing optically active dihydropyran derivative | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1992-10-13 | — | — | US | disclosed |