⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9296753 | 1.00 | — | — | |
| SCHEMBL11195575 | 1.00 | — | — | |
| Methane SCHEMBL28516112 | 0.95 | — | — | |
| SCHEMBL24910398 | 0.70 | — | — | |
| SCHEMBL10041254 | 0.70 | — | — | |
| SCHEMBL17860610 | 0.70 | — | — | |
| SCHEMBL14088271 | 0.70 | — | — | |
| SCHEMBL13648980 | 0.70 | — | — | |
| SCHEMBL851172 | 0.67 | — | — | |
| SCHEMBL2206 | 0.67 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014129796-A1 | SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONISTS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT | LG LIFE SCIENCES LTD. (KR) | 2014-08-28 | — | — | WO | disclosed |
| US-5284962-A | Reacting an oxime or phenol with methyl isocyanate | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-02-08 | — | — | US | disclosed |
| US-4268520-A | Insecticidal and nematicidal carbamates | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1981-05-19 | — | — | US | disclosed |
| US-4225615-A | Insecticidal and nematicidal carbamates | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-09-30 | — | — | US | disclosed |
| EP-0007156-A1 | Carbamates, compositions containing them, their insecticidal and nematocidal use, and a method for their preparation | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-01-23 | — | — | EP | disclosed |
| EP-0005338-A1 | Insecticidal and nematicidal carbamates, and preparation and use thereof | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1979-11-14 | — | — | EP | disclosed |
| EP-0005339-A1 | Biscarbamyl fluoride and preparation thereof | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1979-11-14 | — | — | EP | disclosed |
| US-4127605-A | Substituted carbamate intermediate | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-11-28 | — | — | US | disclosed |