⚠ 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 | |
|---|---|---|---|---|
| Ether SCHEMBL11410598 | 1.00 | ALDH1A1 (0.39) | — | |
| Ether SCHEMBL9798268 | 0.86 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL10688828 | 0.86 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL10681067 | 0.86 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL735420 | 0.86 | — | — | |
| Ether SCHEMBL6 | 0.85 | — | — | |
| SCHEMBL1473 | 0.85 | — | — | |
| Ether SCHEMBL21406 | 0.85 | ALDH1A1 (0.47) | — | |
| Ether SCHEMBL8160191 | 0.85 | ALDH1A1 (0.47) | — | |
| Ether SCHEMBL9248046 | 0.85 | ALDH1A1 (0.47) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0667337-B1 | Method for preparing fluoroanilines | CLARIANT GMBH (DE) | 1998-01-21 | — | — | EP | claimed |
| EP-0667337-A1 | Method for preparing fluoroanilines | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-08-16 | — | — | EP | claimed |
| WO-2004087624-A1 | PROCESS FOR THE SIMULTANEOUS CONVERSION OF METHANE AND ORGANIC OXYGENATE TO C2 TO C10 HYDROCARBONS | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2004-10-14 | — | — | WO | disclosed |
| CN-1129566-C | Method for crystallization of sterically hindered compounds | NYCOMBED IMAGING AS (NO) | 2003-12-03 | — | — | CN | disclosed |
| CN-1273574-A | Process for crystallisation of sterically hindered compound | NYCOMBED IMAGING AS (NO) | 2000-11-15 | — | — | CN | disclosed |
| WO-1998028070-A1 | METHOD AND APPARATUS FOR REDUCING HARMFUL EMISSIONS FROM A LEAN-BURN ENGINE BY UREA INJECTION SCR | CLEAN DIESEL TECHNOLOGIES, INC. (US) | 1998-07-02 | — | — | WO | disclosed |
| EP-0667337-B1 | Method for preparing fluoroanilines | CLARIANT GMBH (DE) | 1998-01-21 | — | — | EP | disclosed |
| EP-0667337-A1 | Method for preparing fluoroanilines | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-08-16 | — | — | EP | disclosed |