⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7600810 | 0.83 | — | — | |
| SCHEMBL7598852 | 0.79 | ALDH1A1 (0.43) | — | |
| SCHEMBL5513888 | 0.67 | TDP1 (0.31) | — | |
| SCHEMBL2288892 | 0.67 | TDP1 (0.31) | — | |
| SCHEMBL8649051 | 0.62 | — | — | |
| SCHEMBL5509512 | 0.62 | — | — | |
| SCHEMBL7624073 | 0.61 | LMNA (0.36) | — | |
| SCHEMBL17180610 | 0.61 | — | — | |
| SCHEMBL11217138 | 0.60 | — | — | |
| SCHEMBL9628774 | 0.59 | APLNR (0.31) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0910660-B1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINES | BAYER CROPSCIENCE AG (DE) | 2003-01-22 | — | — | EP | disclosed |
| EP-1107946-B1 | CYCLOALKYL CARBOXYLIC ACID AMIDES, THEIR PRODUCTION AND THEIR USE AS FUNGICIDES IN AGRICULTURE | BASF AG (DE) | 2002-12-04 | — | — | EP | disclosed |
| EP-0865500-B1 | PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE AMINES | BAYER AG (DE) | 2002-02-13 | — | — | EP | disclosed |
| EP-0759426-B1 | Process for the preparation of optically active 1-aryl-alkylamines | BAYER AG (DE) | 2001-11-28 | — | — | EP | disclosed |
| EP-0812363-B1 | PROCESS FOR PREPARING OPTICALLY ACTIVE AMINES | BAYER AG (DE) | 2001-01-24 | — | — | EP | disclosed |
| EP-0990642-A1 | Cycloalkylcarboxamides, their preparation and their use as fungicides | BASF AKTIENGESELLSCHAFT (DE) | 2000-04-05 | — | — | EP | disclosed |
| EP-0757981-B1 | Process for the preparation of racemic amino derivatives | BAYER AG (DE) | 2000-02-16 | — | — | EP | disclosed |
| EP-0759425-A2 | Process for the preparation of optically active 1-aryl-alkylamines | BAYER AG (DE) | 1997-02-26 | — | — | EP | disclosed |
| EP-0759426-A2 | Process for the preparation of optically active 1-aryl-alkylamines | BAYER AG (DE) | 1997-02-26 | — | — | EP | disclosed |
| EP-0757981-A1 | Process for the preparation of racemic amino derivatives | BAYER AG (DE) | 1997-02-12 | — | — | EP | disclosed |