⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7853984 | 0.83 | USP2 (0.48) | — | |
| SCHEMBL252189 | 0.80 | — | — | |
| SCHEMBL6438627 | 0.80 | — | — | |
| SCHEMBL130847 | 0.69 | — | — | |
| SCHEMBL6437312 | 0.69 | — | — | |
| SCHEMBL11478187 | 0.68 | LMNA (0.38) | — | |
| Propylene Glycol SCHEMBL1357953 | 0.68 | TDP1 (0.43) | — | |
| Mannitol SCHEMBL22613565 | 0.66 | LMNA (0.44) | — | |
| Mannitol SCHEMBL27688977 | 0.66 | LMNA (0.44) | — | |
| SCHEMBL3015993 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115894302-A | Process for the preparation of biuret polyisocyanates | 山东新和成维生素有限公司 | 2023-04-04 | — | — | CN | claimed |
| CN-115894302-A | Process for the preparation of biuret polyisocyanates | 山东新和成维生素有限公司 | 2023-04-04 | — | — | CN | disclosed |
| US-8231960-B2 | Decorative sheet and material | TOYO INK MFG. CO., LTD. (JP) | 2012-07-31 | — | — | US | disclosed |
| US-20070048505-A1 | Decorative sheet and material | TOYO INK MFG. CO., LTD. (JP) | 2007-03-01 | — | — | US | disclosed |