⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5668209 | 0.73 | DRD2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL7583866 | 0.73 | CYP19A1 (0.30) | — | |
| SCHEMBL7208216 | 0.73 | — | — | |
| SCHEMBL2534278 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL547374 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL6910803 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL8160411 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL3763829 | 0.72 | — | — | |
| SCHEMBL8096659 | 0.72 | — | — | |
| SCHEMBL7640892 | 0.72 | — | — |
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-20090156763-A1 | Process for manufacturing a thermoplastic elastomeric material | PIRELLI & C. S.P.A. (IT) | 2009-06-18 | — | — | US | claimed |
| US-20090156763-A1 | Process for manufacturing a thermoplastic elastomeric material | PIRELLI & C. S.P.A. (IT) | 2009-06-18 | — | — | US | disclosed |
| EP-1275662-A1 | MODIFIED PARTICLE, SUPPORT, CATALYST COMPONENT FOR ADDITION POLYMERIZATION, CATALYST FOR ADDITION POLYMERIZATION, AND PROCESS FOR PRODUCING ADDITION POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-01-15 | — | — | EP | disclosed |