⚠ 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 | |
|---|---|---|---|---|
| Chloromethane SCHEMBL3679759 | 0.80 | CYP1A2 (0.32) | — | |
| Chloromethane SCHEMBL3680364 | 0.77 | — | — | |
| SCHEMBL8906349 | 0.72 | HTR2A (0.35) | — | |
| Chloromethane SCHEMBL3681968 | 0.71 | GPR3 (0.30) | — | |
| Hydrochloric Acid SCHEMBL3679754 | 0.70 | ADRA2C (0.31) | — | |
| Hydrochloric Acid SCHEMBL8905301 | 0.69 | HTR2A (0.33) | — | |
| Hydrochloric Acid SCHEMBL3170692 | 0.67 | HTR2A (0.34) | — | |
| Hydrochloric Acid SCHEMBL7938541 | 0.67 | HTR2A (0.34) | — | |
| Methane SCHEMBL8163328 | 0.66 | HTR2A (0.33) | — | |
| Methane SCHEMBL8935403 | 0.66 | HTR2A (0.33) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1302482-B1 | Metallocene catalysts for olefin polymerization and method of polymerizing olefins using the metallocene catalysts | SAMSUNG TOTAL PETROCHEMICALS (KR) | 2015-03-11 | — | — | EP | disclosed |
| EP-1302483-B1 | Metallocene catalysts for olefin polymerization and method of polymerizing olefins using the metallocene catalysts | SAMSUNG ATOFINA CO LTD (KR) | 2013-05-22 | — | — | EP | disclosed |
| EP-2174963-B1 | Metallocene catalysts for olefin polymerization and methog of polymerizing olefins using the metallocene catalysts | SAMSUNG GENERAL CHEMICALS CO (KR) | 2013-02-27 | — | — | EP | disclosed |
| EP-2174963-A2 | Metallocene catalysts for olefin polymerization and methog of polymerizing olefins using the metallocene catalysts | Samsung General Chemicals Co., Ltd. (KR) | 2010-04-14 | — | — | EP | disclosed |
| EP-1302482-A2 | Metallocene catalysts for olefin polymerization and method of polymerizing olefins using the metallocene catalysts | Samsung General Chemicals Co., Ltd. (KR) | 2003-04-16 | — | — | EP | disclosed |
| EP-1302481-A2 | Metallocene catalysts for olefin polymerization and method of polymerizing olefins using the metallocene catalysts | Samsung General Chemicals Co., Ltd. (KR) | 2003-04-16 | — | — | EP | disclosed |
| EP-1302483-A2 | Metallocene catalysts for olefin polymerization and method of polymerizing olefins using the metallocene catalysts | Samsung General Chemicals Co., Ltd. (KR) | 2003-04-16 | — | — | EP | disclosed |
| US-6284701-B1 | COORDINATION POLYMERIZATION CATALYSTS | SAMSUNG GENERAL CHEMICALS CO., LTD. (KR) | 2001-09-04 | — | — | US | disclosed |
| EP-0994132-A1 | Metallocene catalysts for olefin polymerization and method of polymerizing olefins using the metallocene catalysts | Samsung General Chemicals Co., Ltd. (KR) | 2000-04-19 | — | — | EP | disclosed |