⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4401767 | 0.71 | — | — | |
| SCHEMBL16710655 | 0.66 | — | — | |
| SCHEMBL6436737 | 0.62 | — | — | |
| SCHEMBL499994 | 0.62 | — | — | |
| SCHEMBL7648923 | 0.61 | — | — | |
| Water SCHEMBL18302893 | 0.59 | ODC1 (0.47) | — | |
| Hydrochloric Acid SCHEMBL1002442 | 0.59 | — | — | |
| SCHEMBL5786946 | 0.59 | — | — | |
| Ethoxyamine SCHEMBL31471 | 0.59 | — | — | |
| Hydrochloric Acid SCHEMBL11470445 | 0.59 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8927485-B2 | Site-specific modification of proteins through chemical modification enabling protein conjugates, protein dimer formation, and stapled peptides | ADVANCED PROTEOME THERAPEUTICS INC. (US) | 2015-01-06 | — | — | US | disclosed |
| US-20140161830-A1 | AMINE-CONTAINING LIPIDOIDS AND USES THEREOF | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2014-06-12 | — | — | US | disclosed |
| US-20140162980-A1 | NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES | SYNGENTA CROP PROTECTION LLC (US) | 2014-06-12 | — | — | US | disclosed |
| US-20130102631-A1 | NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES | SYNGENTA CROP PROTECTION LLC (US) | 2013-04-25 | — | — | US | disclosed |
| US-20110263832-A1 | SITE-SPECIFIC MODIFICATION OF PROTEINS THROUGH CHEMICAL MODIFICATION ENABLING PROTEIN CONJUGATES, PROTEIN DIMER FORMATION, AND STAPLED PEPTIDES | ADVANCED PROTEOME THERAPEUTICS INC. | 2011-10-27 | — | — | US | disclosed |
| WO-2011103409-A1 | SITE-SPECIFIC MODIFICATION OF PROTEINS THROUGH CHEMICAL MODIFICATION ENABLING PROTEIN CONJUGATES, PROTEIN DIMER FORMATION, AND STAPLED PEPTIDES | ADVANCED PROTEOME THERAPEUTICS INC. (US) | 2011-08-25 | — | — | WO | disclosed |
| US-20100022559-A1 | BISOXIMES AS FUNGICIDES | BAYER CROPSCIENCE AG (DE) | 2010-01-28 | — | — | US | disclosed |