⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5986241 | 0.83 | — | — | |
| SCHEMBL5986236 | 0.83 | — | — | |
| SCHEMBL117779 | 0.78 | — | — | |
| SCHEMBL27786415 | 0.75 | — | — | |
| SCHEMBL5985428 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL28418701 | 0.75 | — | — | |
| SCHEMBL11799860 | 0.75 | — | — | |
| SCHEMBL5985432 | 0.75 | — | — | |
| SCHEMBL8070910 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL1000638 | 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9403822-B2 | Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases | ABBVIE INC. (US) | 2016-08-02 | — | — | US | disclosed |
| EP-2958558-A2 | METHODS AND COMPOSITIONS FOR TREATING LEUKEMIA | Golden Biotechnology Corporation (US) | 2015-12-30 | — | — | EP | disclosed |
| US-20150246914-A1 | APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES | ABBVIE INC (US) | 2015-09-03 | — | — | US | disclosed |
| WO-2014130619-A2 | METHODS AND COMPOSITIONS FOR TREATING LEUKEMIA | GOLDEN BIOTECHNOLOGY CORPORATION (US) | 2014-08-28 | — | — | WO | disclosed |
| US-7098169-B2 | Herbicide-safener combination based on isoxazoline carboxylate safeners | BAYER CROPSCIENCE GMBH (DE) | 2006-08-29 | — | — | US | disclosed |
| US-20050170963-A1 | Herbicide-safener combination based on isoxazoline carboxylate safeners | BAYER CROPSCIENCE GMBH | 2005-08-04 | — | — | US | disclosed |
| CN-1172804-A | Process for producing 1 -substituted -hydantoins | SUMITOMO CHEMICAL CO (JP) | 1998-02-11 | — | — | CN | disclosed |