⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL775329 | 0.71 | — | — | |
| SCHEMBL2841477 | 0.71 | — | — | |
| SCHEMBL21552067 | 0.71 | CRBN (0.50) | — | |
| SCHEMBL21978874 | 0.69 | CRBN (0.56) | — | |
| SCHEMBL942747 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL27590032 | 0.67 | — | — | |
| SCHEMBL17435213 | 0.65 | — | — | |
| SCHEMBL2677621 | 0.65 | CRBN (0.71) | — | |
| SCHEMBL23975525 | 0.64 | CRBN (0.47) | — | |
| SCHEMBL4973748 | 0.64 | CRBN (0.47) | — |
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-2010097334-A1 | DRUG COMBINATIONS CONTAINING PDE4 INHIBITORS AND NSAIDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |