⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9416052 | 0.78 | — | — | |
| SCHEMBL17477671 | 0.75 | — | — | |
| SCHEMBL2217731 | 0.75 | — | — | |
| SCHEMBL2967834 | 0.75 | — | — | |
| SCHEMBL11849644 | 0.72 | — | — | |
| SCHEMBL10926352 | 0.70 | — | — | |
| SCHEMBL1988100 | 0.70 | — | — | |
| SCHEMBL7696886 | 0.70 | — | — | |
| SCHEMBL2549675 | 0.70 | — | — | |
| SCHEMBL7696885 | 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 |
|---|---|---|---|---|---|---|---|
| EP-0588105-A1 | Derivatives of Phosphoryloxypyrazole | BAYER AG (DE) | 1994-03-23 | — | — | EP | claimed |
| US-9923113-B2 | Luminescent solar concentrator comprising tetra-substituted benzoheterodiazole compounds | ENI S.P.A. (IT) | 2018-03-20 | — | — | US | disclosed |
| EP-3036774-B1 | LUMINESCENT SOLAR CONCENTRATOR COMPRISING TETRA- SUBSTITUTED BENZOHETERODIAZOLE COMPOUNDS | ENI SPA (IT) | 2017-08-02 | — | — | EP | disclosed |
| US-20160240713-A1 | LUMINESCENT SOLAR CONCENTRATOR COMPRISING TETRA-SUBSTITUTED BENZOHETERODIAZOLE COMPOUNDS | ENI S.P.A (IT) | 2016-08-18 | — | — | US | disclosed |
| EP-0588105-A1 | Derivatives of Phosphoryloxypyrazole | BAYER AG (DE) | 1994-03-23 | — | — | EP | disclosed |