⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8486814 | 0.85 | ALDH1A1 (0.44) | — | |
| SCHEMBL4913988 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL27722918 | 0.74 | — | — | |
| SCHEMBL13450934 | 0.73 | — | — | |
| SCHEMBL18715970 | 0.73 | — | — | |
| SCHEMBL9452642 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL9512718 | 0.73 | — | — | |
| SCHEMBL19273752 | 0.73 | — | — | |
| SCHEMBL11045907 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL1980632 | 0.73 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4861925-A | Process for the preparation of nitroolefins | W. R. GRACE & CO.-CONN. (US) | 1989-08-29 | — | — | US | claimed |
| US-12032290-B2 | Actinic ray-sensitive or radiation-sensitive resin composition, resist film, pattern forming method, and method for manufacturing electronic device | FUJIFILM CORPORATION (JP) | 2024-07-09 | — | — | US | disclosed |
| US-9205144-B2 | Identification of conserved peptide blocks in homologous polypeptides | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2015-12-08 | — | — | US | disclosed |
| US-8664171-B2 | Nitrated extreme pressure additives and blends | DOVER CHEMICAL CORPORATION (US) | 2014-03-04 | — | — | US | disclosed |
| US-8664171-B2 | Nitrated extreme pressure additives and blends | DOVER CHEMICAL CORPORATION (US) | 2014-03-04 | — | — | US | disclosed |
| US-20130296327-A1 | SUBSTITUTED HETEROCYLIC COMPOUNDS | INCYTE CORPORATION | 2013-11-07 | — | — | US | disclosed |
| US-8058317-B2 | Nitrated extreme pressure additives and blends | DOVER CHEMICAL CORPORATION (US) | 2011-11-15 | — | — | US | disclosed |
| US-20080305974-A1 | NITRATED EXTREME PRESSURE ADDITIVES AND BLENDS | DOVER CHEMICAL CORPORATION (US) | 2008-12-11 | — | — | US | disclosed |
| US-20080305974-A1 | NITRATED EXTREME PRESSURE ADDITIVES AND BLENDS | DOVER CHEMICAL CORPORATION (US) | 2008-12-11 | — | — | US | disclosed |
| WO-2008144691-A1 | NITRATED EXTREME PRESSURE ADDITIVES AND BLENDS | DOVER CHEMICAL COMPANY (US) | 2008-11-27 | — | — | WO | disclosed |
| US-20070270509-A1 | NITRATED EXTREME PRESSURE ADDITIVES AND BLENDS | DOVER CHEMICAL CORPORATION (US) | 2007-11-22 | — | — | US | disclosed |
| US-20070270509-A1 | NITRATED EXTREME PRESSURE ADDITIVES AND BLENDS | DOVER CHEMICAL CORPORATION (US) | 2007-11-22 | — | — | US | disclosed |
| US-4861925-A | Process for the preparation of nitroolefins | W. R. GRACE & CO.-CONN. (US) | 1989-08-29 | — | — | US | disclosed |