⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL717282 | 0.88 | BRD4 (0.35) | — | |
| SCHEMBL1509176 | 0.71 | — | — | |
| SCHEMBL6693515 | 0.69 | — | — | |
| SCHEMBL1414198 | 0.67 | — | — | |
| SCHEMBL8660593 | 0.65 | — | — | |
| SCHEMBL12633322 | 0.65 | — | — | |
| SCHEMBL11726006 | 0.63 | CHRM2 (0.48) | — | |
| SCHEMBL15044829 | 0.63 | PARL (0.33) | — | |
| SCHEMBL723636 | 0.62 | — | — | |
| SCHEMBL8993988 | 0.62 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3253377-B1 | MONOMETHYLFUMARATE PRODRUG COMPOSITIONS | ALKERMES PHARMA IRELAND LTD (IE) | 2021-05-12 | — | — | EP | claimed |
| EP-2101759-B1 | METHODS OF USING MEK INHIBITORS | EXELIXIS INC (US) | 2018-10-10 | — | — | EP | claimed |
| EP-2183239-B1 | SULFONAMIDES AS TRPM8 MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2012-08-22 | — | — | EP | claimed |
| EP-0263492-B1 | RETINOIDS, THEIR PREPARATION AND USE AS PHARMACEUTICAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-03-13 | — | — | EP | claimed |