⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21733288 | 1.00 | — | — | |
| SCHEMBL24311842 | 0.82 | — | — | |
| SCHEMBL21707308 | 0.77 | KDM1A (0.33) | — | |
| Hydrochloric Acid SCHEMBL21680681 | 0.76 | KDM1A (0.33) | — | |
| Hydrochloric Acid SCHEMBL21680678 | 0.76 | KDM1A (0.33) | — | |
| SCHEMBL24311430 | 0.72 | — | — | |
| SCHEMBL20796409 | 0.69 | — | — | |
| SCHEMBL13452967 | 0.69 | GAA (0.30) | — | |
| SCHEMBL20796399 | 0.68 | — | — | |
| SCHEMBL20772067 | 0.68 | ATF4 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11572362-B2 | Pyrrolo[1,2-b]pyridazine derivatives | GILEAD SCIENCES, INC. (US) | 2023-02-07 | — | — | US | disclosed |
| US-20200071333-A1 | PYRROLO[1,2-b]PYRIDAZINE DERIVATIVES | GILEAD SCIENCES, INC. | 2020-03-05 | — | — | US | disclosed |
| WO-2020036979-A1 | PYRROLO[1,2-B]PYRIDAZINE DERIVATIVES AS IRAK4 INHIBITORS | GILEAD SCIENCES, INC. (US) | 2020-02-20 | — | — | WO | disclosed |