⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7400822 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL28360343 | 0.98 | ALOX15 (0.42) | — | |
| Hydrochloric Acid SCHEMBL28360341 | 0.98 | ALOX15 (0.42) | — | |
| Trifluoroacetic Acid SCHEMBL3903912 | 0.88 | ALOX15 (0.35) | — | |
| SCHEMBL2718209 | 0.81 | — | — | |
| SCHEMBL29242517 | 0.81 | ALDH1A1 (0.42) | — | |
| SCHEMBL4544363 | 0.80 | — | — | |
| SCHEMBL22114021 | 0.78 | — | — | |
| SCHEMBL2646866 | 0.78 | — | — | |
| SCHEMBL31757673 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4026835-A2 | PD-1/PD-L1 INHIBITORS | Gilead Sciences, Inc. (US) | 2022-07-13 | — | — | EP | disclosed |
| EP-3612525-B1 | PD-1/PD-L1 INHIBITORS | GILEAD SCIENCES INC (US) | 2021-10-27 | — | — | EP | disclosed |
| US-20210323922-A1 | PD-1/PD-L1 INHIBITORS | GILEAD SCIENCES, INC. (US) | 2021-10-21 | — | — | US | disclosed |