⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6752105 | 0.84 | CRHBP (0.31) | — | |
| SCHEMBL6756891 | 0.81 | — | — | |
| SCHEMBL346178 | 0.72 | — | — | |
| SCHEMBL11312341 | 0.68 | — | — | |
| SCHEMBL3547579 | 0.68 | — | — | |
| SCHEMBL18186102 | 0.68 | — | — | |
| SCHEMBL11081974 | 0.67 | MBTD1 (0.36) | — | |
| SCHEMBL8576907 | 0.64 | — | — | |
| SCHEMBL8518034 | 0.64 | — | — | |
| SCHEMBL28195334 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230241068-A1 | COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR USE IN THE TREATMENT OF FIBROTIC DISEASES | GALAPAGOS NV (BE) | 2023-08-03 | — | — | US | claimed |
| EP-0416520-A1 | Tricyclic quinolizine amides | G.D. Searle & Co. (US) | 1991-03-13 | — | — | EP | disclosed |