⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL133474 | 0.75 | GSK3A (0.39) | — | |
| SCHEMBL530530 | 0.69 | CASP3 (0.40) | — | |
| Water SCHEMBL9841308 | 0.67 | CASP3 (0.39) | — | |
| SCHEMBL24599365 | 0.65 | MEN1 (0.36) | — | |
| SCHEMBL12220326 | 0.65 | ADRA2C (0.32) | — | |
| SCHEMBL6338046 | 0.65 | ADRA2C (0.32) | — | |
| SCHEMBL6614354 | 0.65 | ADRA2C (0.32) | — | |
| SCHEMBL10095225 | 0.63 | ADRA2C (0.30) | — | |
| SCHEMBL3627989 | 0.61 | — | — | |
| SCHEMBL13966826 | 0.61 | MAPT (0.40) | — |
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-0346339-B1 | BARBITURIC ACID COMPOUNDS, PHOTORESISTS THEREFROM AND METHOD FOR PREPARATION | HOECHST CELANESE CORPORATION (US) | 1992-09-09 | — | — | EP | disclosed |
| US-4902784-A | 1,3 Disubstituted-5-diazobarbituric acids | HOECHST CELANESE CORPORATION (US) | 1990-02-20 | — | — | US | disclosed |
| EP-0346339-A1 | BARBITURIC ACID COMPOUNDS, PHOTORESISTS THEREFROM AND METHOD FOR PREPARATION. | HOECHST CELANESE CORP (US) | 1989-12-20 | — | — | EP | disclosed |
| WO-1989005800-A1 | NOVEL BARBITURIC ACID COMPOUNDS, PHOTORESISTS THEREFROM AND METHOD FOR PREPARATION | HOECHST CELANESE CORPORATION (US) | 1989-06-29 | — | — | WO | disclosed |
| US-4735885-A | Deep UV photoresist composition with 1,3-disubstituted-5-diazobarbituric acids | ALLIED CORPORATION (US) | 1988-04-05 | — | — | US | disclosed |