⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15160638 | 0.82 | HDAC8 (0.39) | — | |
| SCHEMBL4864193 | 0.79 | — | — | |
| SCHEMBL4265097 | 0.79 | — | — | |
| SCHEMBL14086544 | 0.79 | — | — | |
| SCHEMBL2983577 | 0.79 | — | — | |
| SCHEMBL20197212 | 0.76 | KDM4E (0.53) | — | |
| SCHEMBL20197181 | 0.76 | HDAC8 (0.37) | — | |
| SCHEMBL14496853 | 0.74 | — | — | |
| SCHEMBL12193022 | 0.74 | — | — | |
| SCHEMBL23181488 | 0.74 | HDAC8 (0.36) | — |
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-2020002238-A1 | COMPOUNDS FOR THE TREATMENT OF BOVINE OR SWINE RESPIRATORY DISEASE | INTERVET INTERNATIONAL B.V. (NL) | 2020-01-02 | — | — | WO | disclosed |