⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL533947 | 0.85 | TSHR (0.40) | — | |
| SCHEMBL533948 | 0.85 | TSHR (0.40) | — | |
| SCHEMBL1536895 | 0.85 | TSHR (0.40) | — | |
| SCHEMBL5716957 | 0.79 | TSHR (0.35) | — | |
| SCHEMBL5716959 | 0.79 | TSHR (0.35) | — | |
| SCHEMBL441436 | 0.76 | TSHR (0.44) | — | |
| SCHEMBL1059084 | 0.76 | — | — | |
| SCHEMBL6876061 | 0.76 | TSHR (0.44) | — | |
| SCHEMBL8766753 | 0.76 | TSHR (0.44) | — | |
| SCHEMBL6876059 | 0.76 | TSHR (0.44) | — |
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-2007095495-A2 | BENZODIAZEPINE GCNF MODULATORS FOR STEM CELL MODULATION | PHARMACOPEIA, INC. (US) | 2007-08-23 | — | — | WO | disclosed |