⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15934975 | 1.00 | — | — | |
| SCHEMBL1177521 | 0.79 | — | — | |
| SCHEMBL18569420 | 0.79 | — | — | |
| SCHEMBL3644434 | 0.79 | — | — | |
| SCHEMBL16258871 | 0.76 | — | — | |
| SCHEMBL17254334 | 0.74 | — | — | |
| SCHEMBL23775629 | 0.72 | — | — | |
| SCHEMBL146686 | 0.72 | — | — | |
| SCHEMBL18569701 | 0.72 | — | — | |
| SCHEMBL19479635 | 0.72 | — | — |
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 |