⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17676190 | 0.84 | — | — | |
| SCHEMBL14135446 | 0.82 | — | — | |
| SCHEMBL19300328 | 0.78 | — | — | |
| SCHEMBL22648650 | 0.74 | — | — | |
| SCHEMBL16934001 | 0.69 | — | — | |
| SCHEMBL14681223 | 0.69 | — | — | |
| SCHEMBL27394977 | 0.69 | — | — | |
| SCHEMBL23409380 | 0.67 | — | — | |
| SCHEMBL17369200 | 0.67 | — | — | |
| SCHEMBL17676188 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20240239788-A1 | SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2024-07-18 | — | — | US | disclosed |
| WO-2023154766-A1 | KRAS MODULATORS AND USES THEREOF | QUANTA THERAPEUTICS, INC. (US) | 2023-08-17 | — | — | WO | disclosed |
| EP-3630771-B1 | 5,6-FUSED-BICYCLIC COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES | NOVARTIS AG (CH) | 2022-06-29 | — | — | EP | disclosed |
| US-9309191-B2 | Amidine compound and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2016-04-12 | — | — | US | disclosed |
| US-9309191-B2 | Amidine compound and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2016-04-12 | — | — | US | disclosed |