⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6572275 | 0.83 | — | — | |
| SCHEMBL1531101 | 0.75 | — | — | |
| SCHEMBL14098643 | 0.73 | ALDH1A1 (0.39) | — | |
| SCHEMBL14641094 | 0.73 | ALDH1A1 (0.32) | — | |
| SCHEMBL11569759 | 0.73 | — | — | |
| SCHEMBL626596 | 0.73 | — | — | |
| SCHEMBL23351173 | 0.72 | — | — | |
| SCHEMBL10285810 | 0.72 | — | — | |
| SCHEMBL1531099 | 0.72 | — | — | |
| SCHEMBL15107925 | 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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5874625-A | Process to hydrogenate organic nitriles to primary amines | HENKEL CORPORATION (US) | 1999-02-23 | — | — | US | claimed |
| WO-1998019991-A1 | IMPROVED PROCESS TO HYDROGENATE ORGANIC NITRILES TO PRIMARY AMINES | HENKEL CORPORATION (US) | 1998-05-14 | — | — | WO | claimed |
| US-8128808-B2 | Process for hydrodesulfurization, hydrodenitrogenation, hydrofinishing, or amine production | H R D CORPORATION (US) | 2012-03-06 | — | — | US | disclosed |
| EP-2379678-A1 | PROCESS FOR HYDRODESULFURIZATION, HYDRODENITROGENATION, HYDROFINISHING, OR AMINE PRODUCTION | H R D Corporation (US) | 2011-10-26 | — | — | EP | disclosed |
| US-20100294699-A1 | PROCESS FOR HYDRODESULFURIZATION, HYDRODENITROGENATION, HYDROFINISHING, OR AMINE PRODUCTION | H R D CORPORATION (US) | 2010-11-25 | — | — | US | disclosed |
| WO-2010090811-A1 | PROCESS FOR HYDRODESULFURIZATION, HYDRODENITROGENATION, HYDROFINISHING, OR AMINE PRODUCTION | H R D CORPORATION (US) | 2010-08-12 | — | — | WO | disclosed |
| WO-2007001848-A2 | HIGH REFRACTIVE INDEX FLUIDS WITH LOW ABSORPTION FOR IMMERSION LITHOGRAPHY | SACHEM, INC. (US) | 2007-01-04 | — | — | WO | disclosed |
| US-5874625-A | Process to hydrogenate organic nitriles to primary amines | HENKEL CORPORATION (US) | 1999-02-23 | — | — | US | disclosed |
| WO-1998019991-A1 | IMPROVED PROCESS TO HYDROGENATE ORGANIC NITRILES TO PRIMARY AMINES | HENKEL CORPORATION (US) | 1998-05-14 | — | — | WO | disclosed |
| US-4739120-A | RHODIUM CATALYST, BASIC SOLUTION OR IMMISCIBLE ORGANIC SOLVENT AND WATER | THE DOW CHEMICAL COMPANY (US) | 1988-04-19 | — | — | US | disclosed |