⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3866843 | 0.72 | — | — | |
| SCHEMBL6249697 | 0.69 | — | — | |
| SCHEMBL14086362 | 0.69 | — | — | |
| SCHEMBL5052555 | 0.69 | — | — | |
| SCHEMBL1155848 | 0.67 | — | — | |
| Ethylamine SCHEMBL27992683 | 0.67 | TDP1 (0.33) | — | |
| SCHEMBL19749096 | 0.67 | — | — | |
| SCHEMBL19361981 | 0.67 | — | — | |
| SCHEMBL12268271 | 0.67 | — | — | |
| SCHEMBL11392188 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6528292-B1 | Derivatized polystyrene and other polymer supports for spectroscopic studies | AVENTIS PHARMACEUTICALS HOLDINGS INC. | 2003-03-04 | — | — | US | disclosed |
| EP-0145386-B1 | DERIVATIZED POLYSTYRENE AND OTHER POLYMER SUPPORTS FOR SPECTROSCOPIC STUDIES | CITY OF HOPE NATIONAL MEDICAL CENTER (US) | 1991-05-15 | — | — | EP | disclosed |
| US-4978724-A | Method of preparing derivatized polystyrene for spectroscopic studies | APPLIED IMMUNESCIENCES, INC. (US) | 1990-12-18 | — | — | US | disclosed |
| EP-0145386-A2 | Derivatized polystyrene and other polymer supports for spectroscopic studies | CITY OF HOPE NATIONAL MEDICAL CENTER (US) | 1985-06-19 | — | — | EP | disclosed |
| US-4294966-A | SALT FORMATION | CIBA-GEIGY CORPORATION (US) | 1981-10-13 | — | — | US | disclosed |