⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL755334 | 0.72 | HSD17B10 (0.41) | — | |
| SCHEMBL6897162 | 0.69 | HSD17B10 (0.39) | — | |
| SCHEMBL6896409 | 0.65 | HSD17B10 (0.42) | — | |
| SCHEMBL80580 | 0.62 | — | — | |
| SCHEMBL59212 | 0.62 | — | — | |
| SCHEMBL8440977 | 0.62 | — | — | |
| SCHEMBL117033 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL25177388 | 0.60 | — | — | |
| SCHEMBL11419191 | 0.60 | — | — | |
| SCHEMBL5699006 | 0.60 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050124747-A1 | Coating composition for ink-jet recording medium and ink-jet recording medium | DEUTSCHE BANK AG, NEW YORK BRANCH, AS COLLATERAL AGENT | 2005-06-09 | — | — | US | disclosed |
| EP-1470928-A1 | COATING COMPOSITION FOR INK-JET RECORDING MEDIUM AND INK-JET RECORDING MEDIUM | Clariant International Ltd. (CH) | 2004-10-27 | — | — | EP | disclosed |
| EP-1114734-A1 | RESIN COMPOSITION FOR INK-JET RECORDING SHEET AND RECORDING SHEET MADE WITH THE SAME | DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) | 2001-07-11 | — | — | EP | disclosed |
| EP-0989162-A1 | THERMOPLASTIC RESIN COMPOSITION, WATER-BASED COMPOSITION, HEAT-SENSITIVE PRESSURE-SENSITIVE ADHESIVE, AND HEAT-SENSITIVE SHEET | Daicel Chemical Industries, Ltd. (JP) | 2000-03-29 | — | — | EP | disclosed |
| EP-0989168-A1 | Water-based coating composition | Daicel Chemical Industries, Ltd. (JP) | 2000-03-29 | — | — | EP | disclosed |