⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7941855 | 0.76 | — | — | |
| SCHEMBL7941861 | 0.69 | — | — | |
| SCHEMBL7079414 | 0.66 | — | — | |
| SCHEMBL28006312 | 0.64 | — | — | |
| SCHEMBL7610143 | 0.63 | — | — | |
| SCHEMBL7610154 | 0.63 | — | — | |
| SCHEMBL9956277 | 0.63 | — | — | |
| SCHEMBL10606394 | 0.62 | — | — | |
| SCHEMBL7941858 | 0.62 | TSHR (0.30) | — | |
| SCHEMBL10606399 | 0.62 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6248811-B1 | COATING SURFACE WITH POLYMER | HUELS AKTIENGESELLSCHAFT (DE) | 2001-06-19 | — | — | US | disclosed |
| US-6218492-B1 | CELL PROLIFERATION INHIBITION | HUELS AKTIENGESELLSCHAFT (DE) | 2001-04-17 | — | — | US | disclosed |