⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5538617 | 0.76 | SLC2A1 (0.39) | — | |
| SCHEMBL4280552 | 0.76 | KDM4E (0.40) | — | |
| SCHEMBL8582933 | 0.75 | — | — | |
| SCHEMBL2067572 | 0.75 | ESR1 (0.35) | — | |
| SCHEMBL9337481 | 0.75 | KCNH3 (0.37) | — | |
| SCHEMBL5472894 | 0.73 | L3MBTL1 (0.36) | — | |
| SCHEMBL19306613 | 0.73 | ALDH1A1 (0.57) | — | |
| SCHEMBL933411 | 0.73 | CYP2C19 (0.49) | — | |
| SCHEMBL4630247 | 0.72 | KCNH3 (0.41) | — | |
| SCHEMBL9505875 | 0.72 | KCNH3 (0.41) | — |
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-20070208021-A1 | Phenoxyacetic Acid Derivatives and Drug Comprising The Same | DAIICHI PHARMACEUTICAL CO., LTD. | 2007-09-06 | — | — | US | disclosed |
| EP-1731513-A1 | PHENOXYACETIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-12-13 | — | — | EP | disclosed |