⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL638313 | 0.77 | — | — | |
| SCHEMBL8242275 | 0.77 | — | — | |
| SCHEMBL7194400 | 0.74 | ALDH1A1 (0.39) | — | |
| SCHEMBL6023550 | 0.74 | KDM4E (0.35) | — | |
| SCHEMBL26347945 | 0.72 | KDM4E (0.33) | — | |
| SCHEMBL28431464 | 0.72 | — | — | |
| SCHEMBL16384472 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL13668652 | 0.72 | ALDH1A1 (0.37) | — | |
| SCHEMBL31255671 | 0.70 | KDM4E (0.33) | — | |
| SCHEMBL5944 | 0.70 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101353862-B | Method of manufacturing fiber flexibile agent for improving flexibility of fiber | FIVE STAR CHEMICAL INDUSTRY CO LTD | 2012-12-12 | — | — | CN | claimed |
| CN-101353862-A | Method of manufacturing fiber flexibile agent for improving flexibility of fiber | FIVE STAR CHEMICAL INDUSTRY CO (KR) | 2009-01-28 | — | — | CN | claimed |
| CN-101353862-B | Method of manufacturing fiber flexibile agent for improving flexibility of fiber | FIVE STAR CHEMICAL INDUSTRY CO LTD | 2012-12-12 | — | — | CN | disclosed |
| US-20050131192-A1 | Polymer and process for producing polymer | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 2005-06-16 | — | — | US | disclosed |
| EP-0632015-B2 | Reductive alkylation of amine to make tertiary amino polyol as precursor of fabric softening esters | PROCTER & GAMBLE (US) | 2001-10-04 | — | — | EP | disclosed |
| EP-0632015-B1 | Reductive alkylation of amine to make tertiary amino polyol as precursor of fabric softening esters | PROCTER & GAMBLE (US) | 1998-05-27 | — | — | EP | disclosed |
| EP-0632015-A1 | Reductive alkylation of amine to make tertiary amino polyol as precursor of fabric softening esters | THE PROCTER & GAMBLE COMPANY (US) | 1995-01-04 | — | — | EP | disclosed |