⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5357783 | 0.86 | AVPR2 (0.31) | — | |
| SCHEMBL2494681 | 0.82 | — | — | |
| SCHEMBL4486166 | 0.77 | — | — | |
| SCHEMBL2495233 | 0.77 | — | — | |
| SCHEMBL2495784 | 0.77 | — | — | |
| SCHEMBL2496918 | 0.77 | — | — | |
| SCHEMBL5070456 | 0.76 | AGTR2 (0.34) | — | |
| SCHEMBL2502694 | 0.74 | UCHL1 (0.40) | — | |
| Trifluoroacetic Acid SCHEMBL2501980 | 0.68 | DPP4 (0.30) | — | |
| Trifluoroacetic Acid SCHEMBL2501984 | 0.67 | DRD2 (0.31) | — |
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-8030499-B2 | 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2011-10-04 | — | — | US | disclosed |
| US-20080318923-A1 | 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2008-12-25 | — | — | US | disclosed |