⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4019932 | 0.77 | — | — | |
| SCHEMBL14976901 | 0.74 | — | — | |
| SCHEMBL5395365 | 0.70 | — | — | |
| SCHEMBL15750872 | 0.67 | — | — | |
| SCHEMBL19888561 | 0.65 | NOS3 (0.30) | — | |
| SCHEMBL31325760 | 0.65 | NOS1 (0.31) | — | |
| SCHEMBL31325740 | 0.65 | NOS1 (0.31) | — | |
| Cyclohexene SCHEMBL9184601 | 0.64 | — | — | |
| SCHEMBL28612524 | 0.64 | — | — | |
| SCHEMBL19779433 | 0.63 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0796839-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 2000-02-09 | — | — | EP | claimed |
| EP-0799817-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1999-06-23 | — | — | EP | claimed |
| EP-0799817-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1997-10-08 | — | — | EP | claimed |
| EP-0796839-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 1997-09-24 | — | — | EP | claimed |
| EP-3224235-B1 | PROCESS FOR THE PREPARATION OF CIS- AND TRANS-ENRICHED MDACH | BASF SE (DE) | 2018-11-14 | — | — | EP | disclosed |
| EP-3224235-A1 | METHOD FOR PRODUCING CIS- AND TRANS-ENRICHED MDACH | BASF SE (DE) | 2017-10-04 | — | — | EP | disclosed |
| WO-2016083210-A1 | METHOD FOR PRODUCING CIS- AND TRANS-ENRICHED MDACH | BASF SE (DE) | 2016-06-02 | — | — | WO | disclosed |
| EP-0796839-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 2000-02-09 | — | — | EP | disclosed |
| EP-0796839-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 2000-02-09 | — | — | EP | disclosed |
| EP-0799817-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1999-06-23 | — | — | EP | disclosed |
| EP-0799817-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1999-06-23 | — | — | EP | disclosed |
| EP-0799817-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1997-10-08 | — | — | EP | disclosed |
| EP-0799817-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1997-10-08 | — | — | EP | disclosed |
| EP-0799817-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1997-10-08 | — | — | EP | disclosed |
| EP-0796839-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 1997-09-24 | — | — | EP | disclosed |
| EP-0796839-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 1997-09-24 | — | — | EP | disclosed |
| EP-0796839-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 1997-09-24 | — | — | EP | disclosed |