⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29374990 | 0.76 | — | — | |
| SCHEMBL28911523 | 0.76 | — | — | |
| SCHEMBL28670460 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL1221783 | 0.74 | — | — | |
| SCHEMBL19966055 | 0.71 | — | — | |
| SCHEMBL3677581 | 0.64 | CYP1A2 (0.42) | — | |
| SCHEMBL11038801 | 0.63 | — | — | |
| SCHEMBL6912163 | 0.63 | GRIN2D (0.31) | — | |
| SCHEMBL28949860 | 0.63 | GRIN2D (0.31) | — | |
| SCHEMBL7175506 | 0.61 | GRIN2D (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115485311-A | Ansa-bis (inden-2-yl) catalysts for the production of vinylidene-terminated polyalphaolefins | 埃克森美孚化学专利公司 | 2022-12-16 | — | — | CN | disclosed |