⚠ 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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL28903315 | 0.81 | — | — | |
| SCHEMBL822080 | 0.74 | CYP3A4 (0.31) | — | |
| SCHEMBL11573555 | 0.72 | CYP3A4 (0.38) | — | |
| SCHEMBL233481 | 0.72 | — | — | |
| SCHEMBL28312956 | 0.71 | — | — | |
| SCHEMBL30087 | 0.71 | — | — | |
| SCHEMBL29760729 | 0.71 | HTT (0.38) | — | |
| SCHEMBL29760757 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL28903314 | 0.71 | — | — | |
| SCHEMBL29760435 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5427858-A | Laminated structure with an electron-injecting layer and a hole-injecting layer | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1995-06-27 | — | — | US | claimed |
| EP-0566736-B1 | ORGANIC ELECTROLUMINESCENCE DEVICE | IDEMITSU KOSAN CO (JP) | 1998-07-29 | — | — | EP | disclosed |
| US-5505985-A | LAMINATED STRUCTURE CONTAINING LIGHT EMITTING LAYER | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1996-04-09 | — | — | US | disclosed |
| US-5427858-A | Laminated structure with an electron-injecting layer and a hole-injecting layer | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1995-06-27 | — | — | US | disclosed |
| EP-0566736-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1993-10-27 | — | — | EP | disclosed |