⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8052989 | 0.74 | — | — | |
| SCHEMBL131822 | 0.72 | — | — | |
| SCHEMBL4671938 | 0.70 | CYP19A1 (0.30) | — | |
| SCHEMBL133874 | 0.70 | CYP19A1 (0.30) | — | |
| SCHEMBL4675178 | 0.70 | CYP19A1 (0.30) | — | |
| SCHEMBL28045865 | 0.69 | — | — | |
| SCHEMBL2918936 | 0.67 | — | — | |
| SCHEMBL622611 | 0.67 | — | — | |
| SCHEMBL6905765 | 0.67 | — | — | |
| SCHEMBL4173299 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0089926-A2 | Pharmaceutical preparations of tetracycles containing nitrogen, and compounds of this type | CIBA-GEIGY AG (CH) | 1983-09-28 | — | — | EP | disclosed |