⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3893565 | 0.81 | — | — | |
| SCHEMBL215138 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28186979 | 0.70 | TDP1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL1801986 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28738290 | 0.67 | — | — | |
| SCHEMBL8658077 | 0.67 | — | — | |
| Water SCHEMBL1682248 | 0.67 | — | — | |
| Bromide SCHEMBL3245759 | 0.67 | — | — | |
| SCHEMBL8529102 | 0.66 | — | — | |
| SCHEMBL28795614 | 0.63 | — | — |
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-2022076496-A1 | PREPARATION OF OXINDOLE DERIVATIVES AS NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2022-04-14 | — | — | WO | disclosed |