⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4811741 | 0.83 | ALDH1A1 (0.33) | — | |
| SCHEMBL4807146 | 0.78 | ALDH1A1 (0.30) | — | |
| SCHEMBL4808477 | 0.78 | ALDH1A1 (0.30) | — | |
| SCHEMBL4806935 | 0.77 | ALDH1A1 (0.31) | — | |
| SCHEMBL4807725 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL4807043 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL7089523 | 0.71 | ALDH1A1 (0.38) | — | |
| SCHEMBL4811208 | 0.69 | USP2 (0.32) | — | |
| SCHEMBL4804780 | 0.68 | NOS2 (0.32) | — | |
| SCHEMBL4806372 | 0.68 | CYP1A2 (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012021578-A8 | USE OF ANGIOTENSIN- II (1-7) IN CELL TRANSPLANTATION AND AS AN AGENT FOR PREVENTING/TREATING NOROVIRUS INFECTION | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2012-05-10 | — | — | WO | disclosed |
| EP-1400516-B1 | SUBSTITUTED ANILIDE DERIVATIVES, INTERMEDIATES THEREOF, AGRICULTURAL AND HORTICULTURAL CHEMICALS, AND THEIR USAGE | NIHON NOHYAKU CO LTD (JP) | 2011-12-07 | — | — | EP | disclosed |
| US-7459477-B2 | Substituted N-phenyl-phenoxy nicotinic acid-(thio)amides and their use as herbicides | NIHON NOHYAKU, CO., LTD. (JP) | 2008-12-02 | — | — | US | disclosed |
| US-20040116744-A1 | Substituted n-phenyl-phenoxy nicotinic acid-(thio)amides and their use as herbicides | NIHON NOHYAKU CO., LTD. (JP) | 2004-06-17 | — | — | US | disclosed |
| EP-1400516-A1 | SUBSTITUTED ANILIDE DERIVATIVES, INTERMEDIATES THEREOF, AGRICULTURAL AND HORTICULTURAL CHEMICALS, AND THEIR USAGE | Nihon Nohyaku Co., Ltd. (JP) | 2004-03-24 | — | — | EP | disclosed |