⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10040877 | 0.72 | — | — | |
| SCHEMBL8344560 | 0.72 | — | — | |
| SCHEMBL256529 | 0.69 | — | — | |
| SCHEMBL16156028 | 0.69 | — | — | |
| SCHEMBL165058 | 0.69 | — | — | |
| SCHEMBL24160898 | 0.69 | — | — | |
| SCHEMBL9977646 | 0.69 | — | — | |
| SCHEMBL10643984 | 0.69 | — | — | |
| SCHEMBL14278793 | 0.67 | — | — | |
| SCHEMBL19828952 | 0.67 | — | — |
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-2011044212-A1 | MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-04-14 | — | — | WO | disclosed |