⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28184795 | 0.79 | NOS3 (0.31) | — | |
| SCHEMBL12503888 | 0.79 | NOS3 (0.31) | — | |
| SCHEMBL166928 | 0.78 | POLB (0.34) | — | |
| SCHEMBL30806180 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL12503883 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL841170 | 0.73 | NOS2 (0.35) | — | |
| SCHEMBL28975701 | 0.73 | — | — | |
| SCHEMBL15262 | 0.70 | HTT (0.38) | — | |
| SCHEMBL9362431 | 0.70 | ALDH1A1 (0.36) | — | |
| SCHEMBL24040662 | 0.70 | NOS3 (0.33) | — |
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-2638088-B1 | HALOGENATION OF 4,4'-METHYLENE-BIS-ANILINES | LONZA AG (CH) | 2015-11-18 | — | — | EP | disclosed |
| EP-2638088-A1 | HALOGENATION OF 4,4'-METHYLENE-BIS-ANILINES | Lonza Ltd (CH) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012028323-A1 | HALOGENATION OF 4,4'-METHYLENE-BIS-ANILINES | LONZA LTD (CH) | 2012-03-08 | — | — | WO | disclosed |
| WO-2012028323-A1 | HALOGENATION OF 4,4'-METHYLENE-BIS-ANILINES | LONZA LTD (CH) | 2012-03-08 | — | — | WO | disclosed |
| EP-0379468-B1 | Curable epoxy resin composition containing a thermoplastic resin having phenolic end groups | CIBA GEIGY AG (CH) | 1995-03-01 | — | — | EP | disclosed |
| US-5006611-A | Prepreg for fiber reinforced composite; adhesive films | CIBA-GEIGY CORPORATION (US) | 1991-04-09 | — | — | US | disclosed |
| EP-0379467-A2 | Nitrogen-containing polymers with terminal hydroxyl groups | CIBA-GEIGY AG (CH) | 1990-07-25 | — | — | EP | disclosed |
| EP-0356392-A2 | Curable epoxy resin mixture | CIBA-GEIGY AG (CH) | 1990-02-28 | — | — | EP | disclosed |