⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4371927 | 0.97 | ALDH1A1 (0.38) | — | |
| SCHEMBL2198815 | 0.90 | — | — | |
| SCHEMBL8984071 | 0.82 | ALOX15 (0.30) | — | |
| SCHEMBL9995632 | 0.79 | FAAH (0.31) | — | |
| SCHEMBL9995662 | 0.79 | — | — | |
| SCHEMBL9995590 | 0.79 | FAAH (0.31) | — | |
| SCHEMBL4652997 | 0.78 | ALOX15 (0.33) | — | |
| SCHEMBL30140053 | 0.78 | ALOX15 (0.33) | — | |
| SCHEMBL22821839 | 0.78 | ALOX15 (0.33) | — | |
| SCHEMBL11617325 | 0.78 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120145955-A1 | COMPOSITION OF HCFO-1233zd AND POLYOL BLENDS FOR USE IN POLYURETHANE FOAM | ARKEMA INC. (US) | 2012-06-14 | — | — | US | claimed |
| EP-2459610-A1 | COMPOSITION OF HCFO-1233zd AND POLYOL BLENDS FOR USE IN POLYURETHANE FOAM | Arkema, Inc. (US) | 2012-06-06 | — | — | EP | claimed |
| WO-2011014441-A1 | COMPOSITION OF HCFO-1233zd AND POLYOL BLENDS FOR USE IN POLYURETHANE FOAM | ARKEMA INC. (US) | 2011-02-03 | — | — | WO | claimed |
| CN-118439921-A | Preparation method of trans-1-bromo-4- [4- (trifluoroalkyl) cyclohexyl ] benzene compound | 陕西莱特光电材料股份有限公司 | 2024-08-06 | — | — | CN | disclosed |