⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17406148 | 0.96 | — | — | |
| SCHEMBL17405446 | 0.94 | HSD17B10 (0.33) | — | |
| SCHEMBL17405424 | 0.94 | — | — | |
| SCHEMBL17405434 | 0.92 | — | — | |
| SCHEMBL17405425 | 0.92 | — | — | |
| SCHEMBL17405586 | 0.92 | — | — | |
| SCHEMBL16275522 | 0.92 | — | — | |
| SCHEMBL17405448 | 0.91 | — | — | |
| SCHEMBL17405432 | 0.90 | — | — | |
| SCHEMBL17405422 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9887367-B2 | Heterocyclic compound, material for organic electroluminescent elements using same, organic electroluminescent element using same, and electronic device | IDEMITSU KOSAN CO., LTD. (JP) | 2018-02-06 | — | — | US | disclosed |
| US-20160005977-A1 | HETEROCYCLIC COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME, ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME, AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2016-01-07 | — | — | US | disclosed |
| US-20160005977-A1 | HETEROCYCLIC COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME, ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME, AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2016-01-07 | — | — | US | disclosed |