⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25762023 | 0.80 | CA1 (0.48) | — | |
| SCHEMBL5229581 | 0.79 | — | — | |
| SCHEMBL5229576 | 0.79 | — | — | |
| SCHEMBL20326321 | 0.77 | — | — | |
| SCHEMBL20326328 | 0.77 | — | — | |
| SCHEMBL20326319 | 0.77 | — | — | |
| SCHEMBL16938118 | 0.77 | CHRNB2 (0.38) | — | |
| SCHEMBL17486509 | 0.77 | CHRNB2 (0.38) | — | |
| SCHEMBL25762049 | 0.77 | — | — | |
| SCHEMBL11500351 | 0.77 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240226113-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | KUMQUAT BIOSCIENCES INC. | 2024-07-11 | — | — | US | disclosed |
| US-20230212164-A1 | ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2023-07-06 | — | — | US | disclosed |
| US-20170144986-A1 | INHIBITOR OF BRUTON'S TYROSINE KINASE | CENTAURUS BIOPHARMA CO., LTD. (CN) | 2017-05-25 | — | — | US | disclosed |
| US-8309582-B2 | Small molecule Bcl-Xl/Bcl-2 binding inhibitors | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2012-11-13 | — | — | US | disclosed |
| US-8309582-B2 | Small molecule Bcl-Xl/Bcl-2 binding inhibitors | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2012-11-13 | — | — | US | disclosed |
| US-20100168184-A1 | SMALL MOLECULE BCL-X1/BCL-2 BINDING INHIBITORS | NATIONAL INSTITUTES OF HEALTH | 2010-07-01 | — | — | US | disclosed |
| US-20100168184-A1 | SMALL MOLECULE BCL-X1/BCL-2 BINDING INHIBITORS | NATIONAL INSTITUTES OF HEALTH | 2010-07-01 | — | — | US | disclosed |
| US-7714005-B2 | Small molecule Bcl-xL/Bcl-2 binding inhibitors | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2010-05-11 | — | — | US | disclosed |
| US-7714005-B2 | Small molecule Bcl-xL/Bcl-2 binding inhibitors | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2010-05-11 | — | — | US | disclosed |
| US-7566787-B2 | Small molecule cyclin D1 ablative agents | THE OHIO STATE UNIVERSITY (US) | 2009-07-28 | — | — | US | disclosed |