⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26537695 | 0.78 | — | — | |
| SCHEMBL15434676 | 0.77 | TDP1 (0.31) | — | |
| SCHEMBL17109663 | 0.76 | ALDH1A1 (0.38) | — | |
| SCHEMBL27342262 | 0.76 | — | — | |
| SCHEMBL21974146 | 0.76 | — | — | |
| SCHEMBL5699477 | 0.76 | — | — | |
| SCHEMBL22592150 | 0.76 | — | — | |
| SCHEMBL16479779 | 0.75 | — | — | |
| SCHEMBL19648602 | 0.74 | — | — | |
| SCHEMBL19172608 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018013676-A1 | SOMATOSTATIN MODULATORS AND USES THEREOF | Crinetics Pharmaceuticals, Inc. (US) | 2018-01-18 | — | — | WO | disclosed |