⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27097 | 0.82 | — | — | |
| SCHEMBL1071382 | 0.82 | — | — | |
| SCHEMBL26413326 | 0.77 | — | — | |
| SCHEMBL9748122 | 0.72 | — | — | |
| SCHEMBL1898302 | 0.72 | — | — | |
| SCHEMBL16246128 | 0.72 | — | — | |
| SCHEMBL18773861 | 0.72 | — | — | |
| SCHEMBL3347195 | 0.72 | — | — | |
| SCHEMBL5435180 | 0.72 | — | — | |
| SCHEMBL10393644 | 0.72 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104781295-B | Addition-fragmentation agents | 3M创新有限公司 | 2017-03-08 | — | — | CN | disclosed |
| CN-104781295-A | ADDITION-FRAGMENTATION AGENTS | 3M INNOVATIVE PROPERTIES CO | 2015-07-15 | — | — | CN | disclosed |
| EP-1817425-B1 | TRICHLORO SILYL ALKYL ISOCYANATE MOLECULE AND SURFACE MODIFIED MINERAL SUBSTRATE | CENTRE NAT RECH SCIENT (FR) | 2013-03-06 | — | — | EP | disclosed |
| US-8067338-B2 | Trichloro silyl alkyl isocyanate molecule and surface modified mineral substrate | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2011-11-29 | — | — | US | disclosed |
| US-20090023590-A1 | Trichloro Silyl Alkyl Isocyanate Molecule and Surface Modified Mineral Substrate | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2009-01-22 | — | — | US | disclosed |
| EP-1817425-A1 | TRICHLORO SILYL ALKYL ISOCYANATE MOLECULE AND SURFACE MODIFIED MINERAL SUBSTRATE | Centre National de la Recherche Scientifique (FR) | 2007-08-15 | — | — | EP | disclosed |
| EP-1817425-A1 | TRICHLORO SILYL ALKYL ISOCYANATE MOLECULE AND SURFACE MODIFIED MINERAL SUBSTRATE | Centre National de la Recherche Scientifique (FR) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006056490-A1 | TRICHLORO SILYL ALKYL ISOCYANATE MOLECULE AND SURFACE MODIFIED MINERAL SUBSTRATE | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2006-06-01 | — | — | WO | disclosed |
| WO-2006056490-A1 | TRICHLORO SILYL ALKYL ISOCYANATE MOLECULE AND SURFACE MODIFIED MINERAL SUBSTRATE | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2006-06-01 | — | — | WO | disclosed |
| CN-1182912-C | Hydrolyzable silane emulsions and process for making same | ��³�նٹ�˾ | 2005-01-05 | — | — | CN | disclosed |
| CN-1358110-A | Hydrolyzable silane emulsions and method for preparing the same | CROMPTON CORP (US) | 2002-07-10 | — | — | CN | disclosed |