⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9723938 | 0.73 | — | — | |
| SCHEMBL329234 | 0.67 | FDPS (0.35) | — | |
| SCHEMBL2104276 | 0.61 | FDPS (0.31) | — | |
| SCHEMBL5948653 | 0.60 | FDPS (0.35) | — | |
| SCHEMBL1252854 | 0.60 | FDPS (0.35) | — | |
| SCHEMBL1231430 | 0.58 | FDPS (0.38) | — | |
| SCHEMBL4921184 | 0.58 | TSHR (0.41) | — | |
| SCHEMBL193496 | 0.58 | — | — | |
| SCHEMBL13452838 | 0.58 | — | — | |
| Ammonia Solution, Strong SCHEMBL15135569 | 0.58 | FDPS (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5149853-A | Organometallic compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1992-09-22 | — | — | US | disclosed |
| US-5112432-A | ORGANOMETALLIC COMPOUNDS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-05-12 | — | — | US | disclosed |
| EP-0260534-B1 | METALLORGANIC COMPOUNDS | MERCK PATENT GmbH (DE) | 1991-12-18 | — | — | EP | disclosed |
| US-4880492-A | Organometallic compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-11-14 | — | — | US | disclosed |
| EP-0260534-A1 | Metallorganic compounds | MERCK PATENT GmbH (DE) | 1988-03-23 | — | — | EP | disclosed |