⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18469748 | 1.00 | — | — | |
| SCHEMBL20463331 | 1.00 | — | — | |
| SCHEMBL18469737 | 1.00 | — | — | |
| SCHEMBL18469738 | 1.00 | — | — | |
| SCHEMBL13609147 | 0.79 | PIK3CD (0.32) | — | |
| SCHEMBL18254235 | 0.78 | HSD17B10 (0.31) | — | |
| SCHEMBL18254232 | 0.78 | HSD17B10 (0.31) | — | |
| SCHEMBL18254230 | 0.78 | HSD17B10 (0.31) | — | |
| SCHEMBL18254231 | 0.78 | HSD17B10 (0.31) | — | |
| SCHEMBL19565558 | 0.78 | HSD17B10 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9868721-B2 | Triazole agonists of the APJ receptor | AMGEN INC. (US) | 2018-01-16 | — | — | US | disclosed |
| US-9656997-B2 | Triazole agonists of the APJ receptor | AMGEN INC. (US) | 2017-05-23 | — | — | US | disclosed |
| US-20170042872-A1 | TRIAZOLE AGONISTS OF THE APJ RECEPTOR | AMGEN INC. | 2017-02-16 | — | — | US | disclosed |
| US-20170037026-A1 | TRIAZOLE AGONISTS OF THE APJ RECEPTOR | AMGEN INC. | 2017-02-09 | — | — | US | disclosed |