⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1053201 | 0.97 | — | — | |
| SCHEMBL27992539 | 0.94 | — | — | |
| SCHEMBL27992317 | 0.94 | — | — | |
| Selenium SCHEMBL11492106 | 0.94 | ABCB11 (0.52) | — | |
| SCHEMBL11563028 | 0.94 | — | — | |
| Methylethylamine SCHEMBL11524258 | 0.85 | ABCB11 (0.44) | — | |
| SCHEMBL27407070 | 0.78 | — | — | |
| SCHEMBL1286323 | 0.74 | — | — | |
| SCHEMBL27361835 | 0.74 | ALDH1A1 (0.46) | — | |
| SCHEMBL434749 | 0.73 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103237782-B | Method for inhibiting unwanted free-radical polymerization of acrylic acid present in liquid phase P | BASF SE (DE) | 2016-01-13 | — | — | CN | disclosed |
| CN-103237782-A | Method for inhibiting unwanted free-radical polymerization of acrylic acid present in liquid phase P | BASF SE | 2013-08-07 | — | — | CN | disclosed |
| CN-101679199-B | Method for distilling liquid containing easily polymerizable compound | NIPPON CATALYTIC CHEM IND | 2013-05-29 | — | — | CN | disclosed |
| CN-1472187-B | Method for producing acrylic acid | NIPPON CATALYTIC CHEM IND | 2010-12-15 | — | — | CN | disclosed |
| CN-101679199-A | Method for distilling liquid containing easily polymerizable compound | NIPPON CATALYTIC CHEM IND | 2010-03-24 | — | — | CN | disclosed |
| CN-100516006-C | Method for producing easily polymerizable substance | NIPPON CATALYTIC CHEM IND (JP) | 2009-07-22 | — | — | CN | disclosed |
| CN-100341841-C | Method for producing acrylic acid | NIPPON CATALYTIC CHEM IND (JP) | 2007-10-10 | — | — | CN | disclosed |
| CN-1250510-C | Process for decomposing Michael type adduct | NIPPON CATALYTIC CHEM IND (JP) | 2006-04-12 | — | — | CN | disclosed |
| CN-1217911-C | Method for preventing easily polymerizable substance from polymerization and method for producing acrylic acid or ester thereof | NIPPON CATALYTIC CHEM IND (JP) | 2005-09-07 | — | — | CN | disclosed |
| CN-1550480-A | Method for producing easily polymerizable substance | 株式会社日本触媒 | 2004-12-01 | — | — | CN | disclosed |
| CN-1480441-A | Process for producing acroleic acid | ��ʽ�����ձ���ý | 2004-03-10 | — | — | CN | disclosed |
| CN-1480442-A | Method for producing acrylic acid | ��ʽ�����ձ���ý | 2004-03-10 | — | — | CN | disclosed |
| CN-1472187-A | Method for producing acrylic acid | ��ʽ�����ձ���ý | 2004-02-04 | — | — | CN | disclosed |
| CN-1453260-A | Process for decomposing Michael type adduct | NIPPON CATALYTIC CHEM IND (JP) | 2003-11-05 | — | — | CN | disclosed |
| CN-1389448-A | Method for preventing easily polymerizable substance from polymerizing and method for producing acrylic acid or ester thereof | NIPPON CATALYTIC CHEM IND (JP) | 2003-01-08 | — | — | CN | disclosed |
| CN-1069305-C | Method of inhibiting vinyl compound polymerization | IDEMITSU PETROCHEMICAL CO (JP) | 2001-08-08 | — | — | CN | disclosed |
| CN-1157606-A | Method of inhibiting vinyl compound polymerization | IDEMITSU PETROCHEMICAL CO (JP) | 1997-08-20 | — | — | CN | disclosed |