⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31114729 | 0.78 | — | — | |
| SCHEMBL3732471 | 0.71 | POLB (0.31) | — | |
| SCHEMBL1845752 | 0.71 | — | — | |
| SCHEMBL19310806 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28009124 | 0.69 | — | — | |
| SCHEMBL28726380 | 0.65 | — | — | |
| SCHEMBL9942213 | 0.59 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL27711098 | 0.59 | — | — | |
| SCHEMBL2541403 | 0.58 | — | — | |
| SCHEMBL19674886 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20240208969-A1 | SUBSTITUTED FUSED BICYCLIC COMPOUNDS AS PARP INHIBITORS AND THE USE THEREOF | IMPACT THERAPEUTICS (SHANGHAI), INC. (CN) | 2024-06-27 | — | — | US | disclosed |