⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10873060 | 0.90 | — | — | |
| SCHEMBL51123 | 0.82 | — | — | |
| SCHEMBL2236673 | 0.79 | — | — | |
| SCHEMBL9812994 | 0.78 | — | — | |
| SCHEMBL51769 | 0.75 | — | — | |
| SCHEMBL9813029 | 0.74 | TACR1 (0.30) | — | |
| SCHEMBL20535408 | 0.72 | — | — | |
| SCHEMBL20535377 | 0.72 | — | — | |
| SCHEMBL20535235 | 0.72 | — | — | |
| SCHEMBL4432862 | 0.72 | SIGMAR1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1220860-B1 | NOVEL FLUOROALKYLSUBSTITUTED CYCLOTRISILOXANES, THEIR USE FOR PREPARATION OF NEW POLYMERS AND NOVEL POLYMERS | UNIV SOUTHERN CALIFORNIA (US) | 2004-09-22 | — | — | EP | disclosed |
| EP-0194684-B1 | A COMPOSITE MEMBRANE FOR USE IN GAS SEPARATION | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1991-03-06 | — | — | EP | disclosed |
| US-4813983-A | POLYSULFONE AND ADDITION POLYMER | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1989-03-21 | — | — | US | disclosed |