⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9510295 | 0.97 | — | — | |
| SCHEMBL28236020 | 0.97 | — | — | |
| SCHEMBL28274508 | 0.81 | FDPS (0.30) | — | |
| SCHEMBL30670284 | 0.81 | TSHR (0.31) | — | |
| SCHEMBL28272076 | 0.78 | FDPS (0.34) | — | |
| SCHEMBL28270569 | 0.74 | FDPS (0.32) | — | |
| SCHEMBL2533726 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL15796332 | 0.71 | — | — | |
| SCHEMBL11428581 | 0.71 | — | — | |
| SCHEMBL11428579 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116964122-A | Polyurea copolymers | 巴斯夫欧洲公司 | 2023-10-27 | — | — | CN | claimed |
| CN-113502042-B | Nano reinforced modified polyester and preparation method thereof | 苏州瀚海新材料有限公司 | 2021-11-26 | — | — | CN | disclosed |
| CN-113502042-A | Nano reinforced modified polyester and preparation method thereof | 苏州瀚海新材料有限公司 | 2021-10-15 | — | — | CN | disclosed |