⚠ 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 | |
|---|---|---|---|---|
| Chlorobenzene SCHEMBL10802495 | 0.96 | TSHR (0.79) | — | |
| Chlorobenzene SCHEMBL10408107 | 0.92 | — | — | |
| Chlorobenzene SCHEMBL1331798 | 0.92 | — | — | |
| Chlorobenzene SCHEMBL2044 | 0.92 | — | — | |
| Chlorobenzene SCHEMBL11220629 | 0.92 | TSHR (1.00) | — | |
| SCHEMBL24715429 | 0.92 | TSHR (1.00) | — | |
| Chlorobenzene SCHEMBL2168046 | 0.92 | TSHR (1.00) | — | |
| Chlorobenzene SCHEMBL1568605 | 0.92 | TSHR (1.00) | — | |
| Chlorobenzene SCHEMBL1330702 | 0.92 | — | — | |
| Chlorobenzene SCHEMBL9721018 | 0.92 | TSHR (1.00) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103664527-A | Clean preparation method for 2,4-dichloro-alpha-chloromethyl benzyl alcohol | XUZHOU COLLEGE IND TECHNOLOGY | 2014-03-26 | — | — | CN | claimed |
| CN-105683204-B | Organo-halogen-silane is mutually directly synthesized by whirlwind particulate slurry | 莫门蒂夫性能材料股份有限公司 | 2019-09-17 | — | — | CN | disclosed |
| CN-103664527-A | Clean preparation method for 2,4-dichloro-alpha-chloromethyl benzyl alcohol | XUZHOU COLLEGE IND TECHNOLOGY | 2014-03-26 | — | — | CN | disclosed |
| CN-102206409-B | Hydrogel forming covalent cross-linking rapidly under mild conditions and preparation method thereof | GUANGZHOU SHENGYU PHARMACEUTICAL CO LTD | 2013-03-13 | — | — | CN | disclosed |
| CN-102206409-A | Hydrogel forming covalent cross-linking rapidly under mild conditions and preparation method thereof | GUANGZHOU SHENGYU PHARMACEUTICAL CO LTD | 2011-10-05 | — | — | CN | disclosed |
| EP-2044044-A2 | SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS | ICOS CORPORATION (US) | 2009-04-08 | — | — | EP | disclosed |
| WO-2007143745-A2 | SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS | ICOS CORPORATION (US) | 2007-12-13 | — | — | WO | disclosed |
| CN-1256338-C | Preparation of organohalosilanes | SHINETSU CHEMICAL CO (JP) | 2006-05-17 | — | — | CN | disclosed |
| CN-1502618-A | Preparation of organohalosilanes | ��Խ��ѧ��ҵ��ʽ���� | 2004-06-09 | — | — | CN | disclosed |