⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL257684 | 0.81 | — | — | |
| SCHEMBL9337825 | 0.81 | GRM1 (0.35) | — | |
| SCHEMBL526663 | 0.81 | GRM1 (0.35) | — | |
| SCHEMBL626555 | 0.79 | — | — | |
| SCHEMBL1858044 | 0.77 | — | — | |
| SCHEMBL8121499 | 0.77 | GSK3B (0.43) | — | |
| SCHEMBL2920821 | 0.77 | GRM1 (0.34) | — | |
| SCHEMBL11384552 | 0.76 | NOTUM (0.33) | — | |
| Hydrochloric Acid SCHEMBL10436896 | 0.76 | CCNC (0.39) | — | |
| SCHEMBL4594945 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2655323-A1 | INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES | LEO LABORATORIES LIMITED (IE) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012083953-A1 | INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES | LEO PHARMA A/S (DK) | 2012-06-28 | — | — | WO | disclosed |
| EP-2207788-A1 | STEROIDAL [3, 2-C]PYRAZOLE COMPOUNDS, WITH GLUCOCORTICOID ACTIVITY | AstraZeneca AB (SE) | 2010-07-21 | — | — | EP | disclosed |
| WO-2009044200-A1 | STEROIDAL [3, 2-C] PYRAZOLE COMPOUNDS, WITH GLUCOCORTICOID ACTIVITY | ASTRAZENECA AB (SE) | 2009-04-09 | — | — | WO | disclosed |
| EP-0462258-A1 | NEW UREIDO DERIVATIVES OF POLY-4-AMINO-2-CARBOXY-1-METHYL COMPOUNDS. | ERBA CARLO SPA (IT) | 1991-12-27 | — | — | EP | disclosed |
| WO-1991010649-A1 | NEW UREIDO DERIVATIVES OF POLY-4-AMINO-2-CARBOXY-1-METHYL COMPOUNDS | FARMITALIA CARLO ERBA S.R.L. (IT) | 1991-07-25 | — | — | WO | disclosed |