⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1485553 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL29156657 | 0.97 | — | — | |
| SCHEMBL1485758 | 0.82 | — | — | |
| SCHEMBL19999905 | 0.82 | — | — | |
| SCHEMBL1556986 | 0.80 | — | — | |
| SCHEMBL1556987 | 0.80 | — | — | |
| SCHEMBL22599146 | 0.80 | — | — | |
| SCHEMBL23273616 | 0.78 | EP300 (0.50) | — | |
| SCHEMBL15263795 | 0.78 | EP300 (0.50) | — | |
| SCHEMBL23273617 | 0.78 | EP300 (0.50) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3165925-B1 | METHODS FOR THE DIAGNOSIS OF COLORECTAL CANCER | MED LIFE DISCOVERIES LP (CA) | 2021-09-08 | — | — | EP | disclosed |
| EP-3165925-A1 | METHODS FOR THE DIAGNOSIS OF COLORECTAL CANCER AND OVARIAN CANCER HEALTH STATES | Phenomenome Discoveries Inc. (CA) | 2017-05-10 | — | — | EP | disclosed |
| US-9593080-B1 | Triazabutadienes as cleavable cross-linkers | THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) | 2017-03-14 | — | — | US | disclosed |
| EP-2646043-B1 | NOVEL CYCLOSPORIN DERIVATIVES FOR THE TREATMENT AND PREVENTION OF A VIRAL INFECTION | S&T GLOBAL INC (US) | 2017-02-15 | — | — | EP | disclosed |
| EP-2140862-A2 | Use of GAL 3 receptor antagonists for the treatment of depression and /or anxiety and compounds useful in such methods | H.Lundbeck A/S (DK) | 2010-01-06 | — | — | EP | disclosed |
| WO-2005051934-A1 | ANTITHROMBOTIC COMPOUNDS WITH DUAL FUNCTION | UNIVERSITY OF LJUBLJANA (SI) | 2005-06-09 | — | — | WO | disclosed |