⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27859440 | 0.98 | — | — | |
| SCHEMBL2309048 | 0.76 | LMNA (0.31) | — | |
| SCHEMBL1505813 | 0.76 | LMNA (0.31) | — | |
| SCHEMBL2456274 | 0.76 | LMNA (0.31) | — | |
| SCHEMBL24429485 | 0.74 | — | — | |
| SCHEMBL26604176 | 0.74 | HTT (0.33) | — | |
| SCHEMBL24429493 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL31094833 | 0.74 | LMNA (0.33) | — | |
| SCHEMBL2053456 | 0.74 | HTT (0.38) | — | |
| SCHEMBL2015280 | 0.74 | HTT (0.38) | — |
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-20220185778-A1 | PROLYL HYDROXYLASE INHIBITORS | AERPIO THERAPEUTICS INC (US) | 2022-06-16 | — | — | US | disclosed |
| EP-1753727-A1 | NOVEL CIS-IMIDAZOLINES | F.HOFFMANN-LA ROCHE AG (CH) | 2007-02-21 | — | — | EP | disclosed |
| WO-2005110996-A1 | NOVEL CIS-IMIDAZOLINES | F.HOFFMANN-LA ROCHE AG (CH) | 2005-11-24 | — | — | WO | disclosed |