⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1614696 | 1.00 | — | — | |
| SCHEMBL1615520 | 0.76 | — | — | |
| SCHEMBL1614672 | 0.76 | — | — | |
| SCHEMBL17817937 | 0.76 | — | — | |
| SCHEMBL17817938 | 0.76 | — | — | |
| SCHEMBL1614671 | 0.76 | — | — | |
| SCHEMBL1615522 | 0.76 | — | — | |
| SCHEMBL1615511 | 0.74 | — | — | |
| SCHEMBL7196852 | 0.73 | — | — | |
| SCHEMBL7196854 | 0.73 | — | — |
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-0892771-B1 | PROCESS FOR THE MANUFACTURE OF HALOGENATED PROPANES CONTAINING END-CARBON FLUORINE | DU PONT (US) | 2003-06-25 | — | — | EP | disclosed |
| US-6066769-A | PRE-FLUORINATING A CHLORINATED PROPANE COMPOUND OF GIVEN FORMULA IN A FIRST STEP AND COMPLETING THE FLUORINATION IN A SECOND, VAPOR PHASE STEP | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-05-23 | — | — | US | disclosed |
| EP-0892771-A1 | PROCESS FOR THE MANUFACTURE OF HALOGENATED PROPANES CONTAINING END-CARBON FLUORINE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1999-01-27 | — | — | EP | disclosed |
| WO-1997037956-A1 | PROCESS FOR THE MANUFACTURE OF HALOGENATED PROPANES CONTAINING END-CARBON FLUORINE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-10-16 | — | — | WO | disclosed |