⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7944951 | 0.69 | — | — | |
| SCHEMBL27553673 | 0.67 | PTPN1 (0.32) | — | |
| SCHEMBL26696399 | 0.64 | NAAA (0.50) | — | |
| SCHEMBL17360032 | 0.62 | RAB9A (0.43) | — | |
| SCHEMBL6889006 | 0.61 | NAAA (0.51) | — | |
| SCHEMBL6889008 | 0.61 | NAAA (0.51) | — | |
| SCHEMBL17360025 | 0.61 | ALDH1A1 (0.41) | — | |
| Acrylic Acid SCHEMBL28699673 | 0.61 | MEN1 (0.41) | — | |
| SCHEMBL8520097 | 0.61 | NAAA (0.41) | — | |
| SCHEMBL3346305 | 0.60 | NAAA (0.53) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6262222-B1 | STABILITY; FOR MICROLITHOGRAPHY | HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) | 2001-07-17 | — | — | US | disclosed |