⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19009437 | 0.75 | — | — | |
| SCHEMBL2614743 | 0.74 | HRH4 (0.33) | — | |
| SCHEMBL19009442 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL28946231 | 0.68 | HRH4 (0.31) | — | |
| SCHEMBL13766095 | 0.65 | — | — | |
| SCHEMBL8755416 | 0.64 | HSP90AA1 (0.31) | — | |
| SCHEMBL19009440 | 0.63 | GCGR (0.33) | — | |
| SCHEMBL1004361 | 0.63 | — | — | |
| SCHEMBL7400206 | 0.61 | ALDH1A1 (0.41) | — | |
| SCHEMBL10910316 | 0.61 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170317294-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-11-02 | — | — | US | disclosed |
| US-20170179402-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-06-22 | — | — | US | disclosed |