⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2604865 | 0.70 | THRB (0.36) | — | |
| SCHEMBL554384 | 0.68 | THRB (0.31) | — | |
| SCHEMBL7579761 | 0.66 | — | — | |
| SCHEMBL555460 | 0.65 | — | — | |
| SCHEMBL11787313 | 0.64 | — | — | |
| SCHEMBL14841405 | 0.64 | — | — | |
| SCHEMBL4250355 | 0.62 | LMNA (0.35) | — | |
| SCHEMBL703913 | 0.62 | — | — | |
| SCHEMBL2927905 | 0.62 | — | — | |
| SCHEMBL28054173 | 0.62 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110408093-A | Rubber composition and pneumatic tire | GOODYEAR TIRE & RUBBER | 2019-11-05 | — | — | CN | disclosed |
| CN-107250252-A | Elastomeric compositions comprising vinyl acetal polymers | 伊士曼化工公司 | 2017-10-13 | — | — | CN | disclosed |
| CN-107207769-A | Elastic composition comprising ionomer | 伊士曼化工公司 | 2017-09-26 | — | — | CN | disclosed |
| CN-106673210-A | Environment-friendly heavy-metal wastewater treating agent and preparation method thereof | 苏州顶裕节能设备有限公司 | 2017-05-17 | — | — | CN | disclosed |
| WO-2008030001-A1 | ELECTRODE MATERIAL CONTAINING MIXTURE OF POLYVINYL ALCOHOL OF HIGH DEGREE OF POLYMERIZATION AND POLYVINYL PYRROLIDONE AS BINDER AND LITHIUM SECONDARY BATTERY EMPLOYED WITH THE SAME | LG CHEM, LTD. (KR) | 2008-03-13 | — | — | WO | disclosed |
| WO-2007083874-A1 | BINDER OF POLYVINYL ALCOHOL CROSSLINKED WITH POLYURETHANE AND LITHIUM SECONDARY BATTERY EMPLOYED WITH THE SAME | LG CHEM, LTD. (KR) | 2007-07-26 | — | — | WO | disclosed |