⚠ 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 | |
|---|---|---|---|---|
| Propylene Oxide SCHEMBL5324063 | 0.94 | ALDH1A1 (0.41) | — | |
| Propylene Oxide SCHEMBL253031 | 0.83 | ALDH1A1 (0.58) | — | |
| SCHEMBL41707 | 0.79 | — | — | |
| SCHEMBL28078236 | 0.79 | MEN1 (0.35) | — | |
| SCHEMBL27917737 | 0.78 | ALDH1A1 (0.36) | — | |
| Propylene Oxide SCHEMBL1091828 | 0.77 | ALDH1A1 (0.52) | — | |
| Cyclohexane SCHEMBL18725857 | 0.76 | ALDH1A1 (0.32) | — | |
| SCHEMBL18335385 | 0.76 | ALDH1A1 (0.32) | — | |
| SCHEMBL7111250 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL15265336 | 0.76 | — | — |
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-106366762-B | Active energy ray-curable ink-jet ink composition and printed article | DNP (JP) | 2019-11-01 | — | — | CN | disclosed |
| CN-106366762-A | Pigment dispersion liquid for inkjet inks, active energy beam-curable inkjet ink, and print | DNP精细化工股份有限公司 | 2017-02-01 | — | — | CN | disclosed |
| CN-104093795-B | Pigment dispersion for inkjet ink, active energy ray-curable inkjet ink, and printed matter | DNP精细化工股份有限公司 | 2016-09-21 | — | — | CN | disclosed |
| US-8734708-B2 | Polar polydimethysiloxane molds, methods of making the molds, and methods of using the molds for pattern transfer | DOW CORNING CORPORATION (US) | 2014-05-27 | — | — | US | disclosed |
| CN-101842745-B | Polar polydimethylsiloxane molds, methods of making the molds, and methods of using the molds for pattern transfer | DOW CORNING | 2013-07-10 | — | — | CN | disclosed |
| CN-101842745-A | Polar polydimethylsiloxane molds, methods of making the molds, and methods of using the molds for pattern transfer | DOW CORNING | 2010-09-22 | — | — | CN | disclosed |
| US-20100206470-A1 | Polar Polydimethysiloxane Molds, Methods of Making the Molds, and Methods of Using the Molds for Pattern Transfer | DOW CORNING CORPORATION | 2010-08-19 | — | — | US | disclosed |
| EP-2206015-A2 | POLAR POLYDIMETHYLSILOXANE MOLDS, METHODS OF MAKING THE MOLDS, AND METHODS OF USING THE MOLDS FOR PATTERN TRANSFER | Dow Corning Corporation (US) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009021249-A2 | POLAR POLYDIMETHYLSILOXANE MOLDS, METHODS OF MAKING THE MOLDS, AND METHODS OF USING THE MOLDS FOR PATTERN TRANSFER | DOW CORNING CORPORATION (US) | 2009-02-12 | — | — | WO | disclosed |