⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10501089 | 0.81 | PAOX (0.46) | — | |
| SCHEMBL4844664 | 0.76 | — | — | |
| SCHEMBL22366429 | 0.75 | — | — | |
| SCHEMBL16585040 | 0.74 | — | — | |
| SCHEMBL7498 | 0.72 | — | — | |
| SCHEMBL11794996 | 0.72 | ALDH1A1 (0.50) | — | |
| SCHEMBL6355833 | 0.72 | — | — | |
| SCHEMBL11009268 | 0.71 | ALDH1A1 (0.56) | — | |
| SCHEMBL11009265 | 0.71 | ALDH1A1 (0.56) | — | |
| Acetone SCHEMBL8891841 | 0.70 | ALDH1A1 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108713046-B | Aqueous coating composition | 关西涂料株式会社 | 2020-05-22 | — | — | CN | disclosed |
| US-6280897-B1 | GENERATION OF ACID WITH ACTINIC RADIATION | KABUSHIKI KAISHA TOSHIBA (JP) | 2001-08-28 | — | — | US | disclosed |
| US-5932391-A | CONTAINING AN ACYCLIC COMPOUND WHICH IS A VINYL POLYMERBEING LIGHT ABSORBENT | KABUSHIKI KAISHA TOSHIBA (JP) | 1999-08-03 | — | — | US | disclosed |
| US-5863699-A | FORMS A PATTERN THROUGH LIGHT-EXPOSURE WITH EITHER ARGON FLUORIDE OR FLUORINE EXCIMER LASERS, COMPRISES A COMPOUND HAVING EITHER AN ACID-DECOMPOSABLE OR ACID-CROSSLINKABLE GROUP | KABUSHIKI KAISHA TOSHIBA (JP) | 1999-01-26 | — | — | US | disclosed |