⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19367719 | 0.84 | KMT2A (0.31) | — | |
| SCHEMBL26883170 | 0.82 | LMNA (0.33) | — | |
| SCHEMBL25713711 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL24844830 | 0.80 | — | — | |
| SCHEMBL2622404 | 0.80 | KMT2A (0.37) | — | |
| SCHEMBL2625534 | 0.80 | KMT2A (0.37) | — | |
| SCHEMBL2625532 | 0.80 | KMT2A (0.37) | — | |
| SCHEMBL329518 | 0.80 | KMT2A (0.38) | — | |
| SCHEMBL18632851 | 0.79 | KMT2A (0.32) | — | |
| SCHEMBL6985391 | 0.74 | KMT2A (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11191762-B2 | Alkyl substituted triazole compounds as agonists of the APJ Receptor | AMGEN INC. (US) | 2021-12-07 | — | — | US | disclosed |
| US-20190290647-A1 | ALKYL SUBSTITUTED TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR | AMGEN INC. (US) | 2019-09-26 | — | — | US | disclosed |