⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL177706 | 0.75 | — | — | |
| SCHEMBL6266494 | 0.69 | — | — | |
| SCHEMBL270711 | 0.69 | — | — | |
| SCHEMBL271482 | 0.67 | — | — | |
| SCHEMBL11633803 | 0.67 | — | — | |
| SCHEMBL966689 | 0.67 | — | — | |
| SCHEMBL9314986 | 0.67 | — | — | |
| SCHEMBL27682079 | 0.67 | CHRM1 (0.32) | — | |
| SCHEMBL290193 | 0.66 | — | — | |
| SCHEMBL23044847 | 0.65 | HTR2A (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7196133-B2 | Surface tension control agent for coating material and coating material containing same | KYOEISHA CHEMICAL CO., LTD. (JP) | 2007-03-27 | — | — | US | disclosed |
| US-20060167170-A1 | Surface tension control agent for coating material and coating material containing same | KYOEISHA CHEMICAL CO., LTD (JP) | 2006-07-27 | — | — | US | disclosed |
| EP-1642947-A1 | SURFACE TENSION CONTROL AGENT FOR COATING MATERIAL AND COATING MATERIAL CONTAINING SAME | Kyoeisha Chemical Co., Ltd. (JP) | 2006-04-05 | — | — | EP | disclosed |