⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17140176 | 0.93 | — | — | |
| SCHEMBL29094124 | 0.83 | — | — | |
| SCHEMBL9184831 | 0.79 | — | — | |
| SCHEMBL9449654 | 0.76 | — | — | |
| SCHEMBL9155172 | 0.75 | — | — | |
| SCHEMBL15402586 | 0.75 | — | — | |
| SCHEMBL6940066 | 0.73 | — | — | |
| SCHEMBL17140174 | 0.72 | — | — | |
| SCHEMBL461233 | 0.71 | DNM1 (0.32) | — | |
| SCHEMBL10931541 | 0.70 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6369179-B1 | 1H,1H-PERFLUOROCYCLOHEXYLMETHYL 2-FLUOROACRYLATE; OPTICAL FIBERS | MINNESOTA MINING AND MANUFACTURING COMPANY | 2002-04-09 | — | — | US | disclosed |
| US-6018008-A | PLASTIC OPTICAL FIBER WITH CORE FORMED OF A HOMOPOLYMER OF 1H,1H-PERFLUOROCYCLOHEXYLMETHYL 2-FLUOROACRYLATE; IMPROVED THERMAL PROPERTIES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2000-01-25 | — | — | US | disclosed |
| EP-0738255-B1 | 2-FLUOROACRYLATE ESTER POLYMERS AND USE THEREOF AS OPTICAL MATERIALS | MINNESOTA MINING & MFG (US) | 1998-04-22 | — | — | EP | disclosed |