⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5252957 | 1.00 | — | — | |
| SCHEMBL27835327 | 0.79 | CHRM2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL27763502 | 0.77 | CHRM2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL4427864 | 0.77 | CHRM2 (0.33) | — | |
| SCHEMBL2558329 | 0.76 | DPP4 (0.31) | — | |
| SCHEMBL1989780 | 0.76 | DPP4 (0.31) | — | |
| SCHEMBL2562325 | 0.76 | DPP4 (0.31) | — | |
| SCHEMBL2462437 | 0.76 | CHRNB2 (0.32) | — | |
| SCHEMBL5503960 | 0.69 | GLI1 (0.39) | — | |
| SCHEMBL12436874 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1861392-A2 | SUBSTITUTED OXINDOL DERIVATIVES, DRUGS CONTAINING SAID DERIVATIVES AND THE USE THEREOF | Abbott GmbH & Co. KG (DE) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006100082-A2 | SUBSTITUTED OXINDOL DERIVATIVES, DRUGS CONTAINING SAID DERIVATIVES AND THE USE THEREOF | ABBOTT GMBH & CO. KG (DE) | 2006-09-28 | — | — | WO | disclosed |