⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12801166 | 0.72 | — | — | |
| SCHEMBL8267358 | 0.70 | — | — | |
| SCHEMBL13305422 | 0.70 | — | — | |
| SCHEMBL13992534 | 0.70 | — | — | |
| SCHEMBL2632684 | 0.70 | — | — | |
| SCHEMBL24739021 | 0.70 | — | — | |
| SCHEMBL12719973 | 0.70 | — | — | |
| SCHEMBL21650461 | 0.70 | — | — | |
| SCHEMBL21539984 | 0.70 | — | — | |
| SCHEMBL13535732 | 0.70 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012065022-A2 | SPIRO-OXINDOLE MDM2 ANTAGONISTS | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2012-05-18 | — | — | WO | disclosed |
| US-3852366-A | A COMPOSITION OF ISOMERIC TRICHLORODIFLUOROBENZENES | DU PONT | 1974-12-03 | — | — | US | disclosed |
| US-3774393-A | METHOD OF GENERATING POWER | DU PONT | 1973-11-27 | — | — | US | disclosed |