⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3403134 | 0.77 | — | — | |
| SCHEMBL3402313 | 0.76 | ACHE (0.35) | — | |
| SCHEMBL3403369 | 0.71 | ACHE (0.33) | — | |
| SCHEMBL16743886 | 0.70 | — | — | |
| SCHEMBL765181 | 0.68 | ACHE (0.31) | — | |
| SCHEMBL30831362 | 0.67 | — | — | |
| SCHEMBL23432218 | 0.59 | ALDH1A1 (0.30) | — | |
| SCHEMBL10014491 | 0.57 | — | — | |
| SCHEMBL19277433 | 0.57 | — | — | |
| SCHEMBL27907192 | 0.55 | KDM1A (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2508503-A1 | Spiro compounds and pharmaceutical use thereof | Japan Tobacco, Inc. (JP) | 2012-10-10 | — | — | EP | disclosed |
| EP-2202216-A1 | SPIRO-RING COMPOUND AND USE THEREOF FOR MEDICAL PURPOSES | Japan Tobacco Inc. (JP) | 2010-06-30 | — | — | EP | disclosed |