⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3668918 | 0.78 | — | — | |
| SCHEMBL3676791 | 0.75 | NOS3 (0.40) | — | |
| SCHEMBL13348018 | 0.75 | NOS3 (0.40) | — | |
| SCHEMBL12514645 | 0.75 | NOS3 (0.40) | — | |
| SCHEMBL19850752 | 0.71 | — | — | |
| SCHEMBL9795604 | 0.71 | — | — | |
| SCHEMBL763460 | 0.71 | — | — | |
| SCHEMBL515670 | 0.64 | — | — | |
| SCHEMBL583260 | 0.56 | — | — | |
| SCHEMBL1246293 | 0.47 | MEN1 (0.30) | — |
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-119143965-A | Polyurethane elastomer adopting squaric amide chain extension and preparation method thereof | 南京林业大学 | 2024-12-17 | — | — | CN | disclosed |
| US-20230138150-A1 | RADIO-PROTECTIVE AND CHEMO-PROTECTIVE SUBSTITUTED THIOLS | Tonix Pharmaceuticals, Inc. | 2023-05-04 | — | — | US | disclosed |
| CN-115968372-A | Radioprotective and chemoprotective compounds | 通尼克斯医药有限公司 | 2023-04-14 | — | — | CN | disclosed |
| US-10865213-B2 | Max binders as MYC modulators and uses thereof | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2020-12-15 | — | — | US | disclosed |
| US-20190144466-A1 | MAX BINDERS AS MYC MODULATORS AND USES THEREOF | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2019-05-16 | — | — | US | disclosed |
| EP-2010509-A1 | 3,4-DIAMINO-3-CYCLOBUTENE-1,2-DIONE DERIVATIVES AS POTASSIUM CHANNEL OPENERS | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007115071-A1 | 3,4-DIAMINO-3-CYCLOBUTENE-1,2-DIONE DERIVATIVES AS POTASSIUM CHANNEL OPENERS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-10-11 | — | — | WO | disclosed |
| US-20030150358-A1 | Silicone weatherproofing compositions | GENERAL ELECTRIC COMPANY | 2003-08-14 | — | — | US | disclosed |
| US-20020037957-A1 | Silicone weatherproofing compositions | GENERAL ELECTRIC COMPANY | 2002-03-28 | — | — | US | disclosed |