⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL9088948 | 0.99 | — | — | |
| SCHEMBL9087802 | 0.89 | — | — | |
| SCHEMBL9308272 | 0.89 | EDNRB (0.58) | — | |
| SCHEMBL9091168 | 0.82 | — | — | |
| SCHEMBL9124539 | 0.80 | — | — | |
| SCHEMBL9127878 | 0.79 | — | — | |
| SCHEMBL9308108 | 0.78 | — | — | |
| SCHEMBL8999400 | 0.78 | — | — | |
| SCHEMBL8999434 | 0.78 | — | — | |
| SCHEMBL8999179 | 0.75 | — | — |
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-5519138-A | ANGIOTENSIN ANTAGONIST | DR. KARL THOMAE GMBH (DE) | 1996-05-21 | — | — | US | disclosed |
| EP-0529253-A1 | Phenylalkylderivatives, compounds containing them and process for their fabrication | Dr. Karl Thomae GmbH (DE) | 1993-03-03 | — | — | EP | disclosed |