⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL738247 | 0.80 | HRH3 (0.33) | — | |
| SCHEMBL737952 | 0.77 | HRH3 (0.33) | — | |
| SCHEMBL16268871 | 0.77 | — | — | |
| SCHEMBL738008 | 0.74 | HRH3 (0.41) | — | |
| SCHEMBL16830912 | 0.72 | — | — | |
| SCHEMBL9925606 | 0.72 | — | — | |
| SCHEMBL683603 | 0.71 | — | — | |
| SCHEMBL14921679 | 0.70 | NOS3 (0.38) | — | |
| SCHEMBL20327115 | 0.69 | NOS3 (0.31) | — | |
| SCHEMBL16625960 | 0.69 | NOS3 (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3160960-B1 | PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | GILEAD SCIENCES INC (US) | 2021-10-13 | — | — | EP | disclosed |
| US-20180065953-A1 | PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | GILEAD SCIENCES, INC. | 2018-03-08 | — | — | US | disclosed |
| US-9765060-B2 | Phosphatidylinositol 3-kinase inhibitors | GILEAD SCIENCES, INC. (US) | 2017-09-19 | — | — | US | disclosed |
| US-20160024054-A1 | PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | GILEAD SCIENCES, INC. | 2016-01-28 | — | — | US | disclosed |