⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28886975 | 0.72 | — | — | |
| SCHEMBL10349198 | 0.72 | — | — | |
| SCHEMBL1187300 | 0.70 | — | — | |
| SCHEMBL1992270 | 0.67 | — | — | |
| SCHEMBL9109310 | 0.67 | — | — | |
| SCHEMBL8633866 | 0.67 | — | — | |
| SCHEMBL4443792 | 0.65 | — | — | |
| SCHEMBL14817620 | 0.65 | — | — | |
| SCHEMBL6439536 | 0.65 | — | — | |
| SCHEMBL140330 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114131923-B | Method for producing polyurethane three-dimensional objects from materials having multiple hardening mechanisms | 卡本有限公司 | 2024-05-24 | — | — | CN | disclosed |