⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6995825 | 0.91 | — | — | |
| SCHEMBL701014 | 0.82 | — | — | |
| SCHEMBL6384937 | 0.81 | — | — | |
| SCHEMBL6982486 | 0.81 | — | — | |
| SCHEMBL5638953 | 0.81 | — | — | |
| SCHEMBL5637534 | 0.78 | TUBB4A (0.32) | — | |
| SCHEMBL701516 | 0.76 | — | — | |
| SCHEMBL6989149 | 0.73 | — | — | |
| SCHEMBL30480757 | 0.70 | ALOX15 (0.31) | — | |
| SCHEMBL5638801 | 0.69 | GAA (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7301034-B2 | Preparation of -4-thioalkybrobenzene derivatives | BASF AKTIENGESELLSCHAFT (DE) | 2007-11-27 | — | — | US | claimed |
| EP-1301469-B1 | PREPARATION OF 4-THIOALKYLBROMOBENZENE DERIVATIVES | BASF AG (DE) | 2006-06-21 | — | — | EP | claimed |
| US-20030149276-A1 | Preparation of -4-thioalkybrobenzene derivatives | BASF AKTIENGESELLSCHAFT (DE) | 2003-08-07 | — | — | US | claimed |
| US-7301034-B2 | Preparation of -4-thioalkybrobenzene derivatives | BASF AKTIENGESELLSCHAFT (DE) | 2007-11-27 | — | — | US | disclosed |
| EP-1301469-B1 | PREPARATION OF 4-THIOALKYLBROMOBENZENE DERIVATIVES | BASF AG (DE) | 2006-06-21 | — | — | EP | disclosed |
| US-20030149276-A1 | Preparation of -4-thioalkybrobenzene derivatives | BASF AKTIENGESELLSCHAFT (DE) | 2003-08-07 | — | — | US | disclosed |