⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL969293 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL4435490 | 0.78 | TSHR (0.39) | — | |
| SCHEMBL1684296 | 0.69 | — | — | |
| SCHEMBL10902351 | 0.67 | FDPS (0.36) | — | |
| SCHEMBL3869376 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL1885730 | 0.62 | TSHR (0.38) | — | |
| SCHEMBL16287226 | 0.62 | TSHR (0.33) | — | |
| SCHEMBL597579 | 0.62 | TSHR (0.33) | — | |
| SCHEMBL9248668 | 0.62 | TSHR (0.33) | — | |
| SCHEMBL25100119 | 0.60 | — | — |
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-20100030000-A1 | PRODUCTION METHOD OF ALPHA-OLEFIN LOW POLYMER AND STORAGE METHOD OF PYRROLE COMPOUND | MITSUBISHI CHEMICAL CORPORATION (JP) | 2010-02-04 | — | — | US | disclosed |
| EP-0696600-A2 | Catalyst and polymerization of olefins | PHILLIPS PETROLEUM COMPANY (US) | 1996-02-14 | — | — | EP | disclosed |
| US-4330432-A | Catalyst composition | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1982-05-18 | — | — | US | disclosed |
| US-4329255-A | POLYMERIZATION CATALYSTS | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1982-05-11 | — | — | US | disclosed |
| US-3988333-A | Tri-substituted aluminum salts or di-substituted aluminum salts of carboxyl group-containing, pharmaceutically effective compounds | TEIKOKU HORMONE MFG. CO., LTD. (JA) | 1976-10-26 | — | — | US | disclosed |