⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20435383 | 0.86 | — | — | |
| SCHEMBL17772287 | 0.84 | TDP1 (0.35) | — | |
| SCHEMBL21122916 | 0.77 | — | — | |
| SCHEMBL7112353 | 0.77 | — | — | |
| SCHEMBL14655038 | 0.74 | TDP1 (0.30) | — | |
| SCHEMBL15588563 | 0.74 | — | — | |
| SCHEMBL21159766 | 0.72 | — | — | |
| SCHEMBL22554453 | 0.70 | — | — | |
| SCHEMBL26108111 | 0.70 | — | — | |
| SCHEMBL8649346 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022140290-A1 | PYRAZOLE DERIVATIVES USEFUL AS NAMPT MODULATORS | CYTOKINETICS, INC. (US) | 2022-06-30 | — | — | WO | disclosed |
| US-20170352821-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | UNIVERSAL DISPLAY CORPORATION (US) | 2017-12-07 | — | — | US | disclosed |