⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11212045 | 1.00 | — | — | |
| SCHEMBL15610126 | 0.86 | ITGB1 (0.74) | — | |
| SCHEMBL9518464 | 0.83 | ITGB1 (0.70) | — | |
| SCHEMBL10680131 | 0.79 | — | — | |
| SCHEMBL10685896 | 0.79 | — | — | |
| SCHEMBL11062751 | 0.79 | — | — | |
| SCHEMBL7264417 | 0.77 | ITGB1 (0.63) | — | |
| SCHEMBL9621834 | 0.76 | ITGB1 (0.61) | — | |
| SCHEMBL9377695 | 0.76 | ITGB1 (0.61) | — | |
| SCHEMBL18705948 | 0.76 | ITGB1 (0.61) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57026659-A | — | — | None | — | — | JP | disclosed |
| JP-59102397-A | — | — | None | — | — | JP | disclosed |
| JP-56145270-A | — | — | None | — | — | JP | disclosed |
| JP-S59102397-A | METHOD FOR HYDROLYZING ESTER | TEIKOKU HORMONE MFG CO LTD | 1984-06-13 | — | — | JP | disclosed |
| JP-S5726659-A | 4R -4- 3,3-BIS CARBOXY -2-OXO-PROPYL -2-AZETIDINONE DERIVATIVE AND ITS PREPARATION | TOYAMA CHEM CO LTD | 1982-02-12 | — | — | JP | disclosed |
| JP-S56145270-A | 4R -4- 3-SUBSTITUTED CARBOXY-2-OXO-PROPYL -2-AZETIDINONE AND ITS PREPARATION | TOYAMA CHEM CO LTD | 1981-11-11 | — | — | JP | disclosed |