⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16079088 | 0.78 | — | — | |
| SCHEMBL3308860 | 0.78 | — | — | |
| SCHEMBL11412963 | 0.78 | — | — | |
| SCHEMBL27176240 | 0.77 | FDPS (0.35) | — | |
| SCHEMBL28243388 | 0.77 | FDPS (0.35) | — | |
| SCHEMBL15900310 | 0.75 | HDAC1 (0.39) | — | |
| SCHEMBL1990724 | 0.75 | — | — | |
| SCHEMBL23264871 | 0.74 | FDPS (0.33) | — | |
| SCHEMBL28530484 | 0.74 | TSHR (0.35) | — | |
| SCHEMBL16076616 | 0.74 | FDPS (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-RE49517-E1 | Pyrazoles | Janssen Pharmaceuticals, Inc. (US) | 2023-05-02 | — | — | US | disclosed |
| EP-3180315-B1 | PYRAZOLES | JANSSEN PHARMACEUTICALS INC (US) | 2020-03-18 | — | — | EP | disclosed |
| US-10155727-B2 | Pyrazoles | Janssen Pharmaceuticals, Inc. (US) | 2018-12-18 | — | — | US | disclosed |
| US-20170275254-A1 | PYRAZOLES | JANSSEN PHARMACEUTICALS INC (US) | 2017-09-28 | — | — | US | disclosed |
| EP-3180315-A1 | PYRAZOLES | Janssen Pharmaceuticals, Inc. (US) | 2017-06-21 | — | — | EP | disclosed |
| WO-2016025918-A1 | PYRAZOLES | Janssen Pharmaceuticals, Inc. (US) | 2016-02-18 | — | — | WO | disclosed |