⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11357920 | 0.67 | — | — | |
| SCHEMBL11357918 | 0.67 | — | — | |
| SCHEMBL9124049 | 0.67 | — | — | |
| SCHEMBL990561 | 0.64 | — | — | |
| SCHEMBL11304746 | 0.61 | — | — | |
| SCHEMBL11304750 | 0.61 | — | — | |
| SCHEMBL48840 | 0.61 | — | — | |
| SCHEMBL6207578 | 0.61 | — | — | |
| SCHEMBL6207575 | 0.61 | — | — | |
| SCHEMBL9007444 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104610752-B | UV curability adhesiveness organopolysiloxane composition | 信越化学工业株式会社 | 2019-05-28 | — | — | CN | disclosed |
| CN-101039898-B | Titanium compound and process for producing optically active cyanohydrins | MITSUI CHEMICALS INC | 2012-01-11 | — | — | CN | disclosed |
| US-7732544-B2 | Titanium compound and process for producing optically active cyanohydrins | MITSUI CHEMICALS, INC. (JP) | 2010-06-08 | — | — | US | disclosed |
| EP-1806336-B1 | TITANIUM COMPOUND AND METHOD FOR PRODUCING OPTICALLY ACTIVE CYANOHYDRINS | MITSUI CHEMICALS INC (JP) | 2009-09-30 | — | — | EP | disclosed |
| US-20070265463-A1 | Titanium Compound and Process for Producing Optically Active Cyanohydrins | MITSUI CHEMICALS, INC. (JP) | 2007-11-15 | — | — | US | disclosed |
| CN-101039898-A | Titanium compound and process for producing optically active cyanohydrins | MITSUI CHEMICALS INC (JP) | 2007-09-19 | — | — | CN | disclosed |
| EP-1806336-A1 | TITANIUM COMPOUND AND METHOD FOR PRODUCING OPTICALLY ACTIVE CYANOHYDRINS | Mitsui Chemicals, Inc. (JP) | 2007-07-11 | — | — | EP | disclosed |
| CN-1040105-C | Aminoketone derivatives and use thereof | MITZUI TOATSU CHEMICALS INC (JP) | 1998-10-07 | — | — | CN | disclosed |
| CN-1049660-A | Aminoketone derivative and application thereof | MITZUI TOATSU CHEMICALS INC (JP) | 1991-03-06 | — | — | CN | disclosed |