⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3804174 | 0.75 | — | — | |
| SCHEMBL27526976 | 0.67 | MAPT (0.30) | — | |
| SCHEMBL3293899 | 0.64 | MAPT (0.42) | — | |
| SCHEMBL7135080 | 0.64 | — | — | |
| SCHEMBL23181453 | 0.64 | — | — | |
| SCHEMBL30572434 | 0.64 | — | — | |
| SCHEMBL27626269 | 0.63 | CYP2D6 (0.30) | — | |
| SCHEMBL10729515 | 0.63 | — | — | |
| SCHEMBL15263 | 0.62 | — | — | |
| SCHEMBL6739420 | 0.62 | — | — |
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-2273982-A2 | DRUG DEPOTS HAVING DIFFERENT RELEASE PROFILES FOR REDUCING, PREVENTING OR TREATING PAIN AND INFLAMMATION | Warsaw Orthopedic, Inc. (US) | 2011-01-19 | — | — | EP | disclosed |
| WO-2009129149-A2 | DRUG DEPOTS HAVING DIFFERENT RELEASE PROFILES FOR REDUCING, PREVENTING OR TREATING PAIN AND INFLAMMATION | WARSAW ORTHOPEDIC, INC. (US) | 2009-10-22 | — | — | WO | disclosed |