⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29197377 | 0.92 | — | — | |
| SCHEMBL7723071 | 0.75 | — | — | |
| SCHEMBL865715 | 0.71 | — | — | |
| SCHEMBL9247506 | 0.71 | — | — | |
| SCHEMBL4941402 | 0.71 | — | — | |
| SCHEMBL9250231 | 0.71 | — | — | |
| SCHEMBL10822098 | 0.71 | — | — | |
| SCHEMBL434152 | 0.71 | — | — | |
| SCHEMBL3245538 | 0.71 | — | — | |
| SCHEMBL11600744 | 0.71 | — | — |
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-5466691-A | Antipsychotic and anxiolytic agents | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1995-11-14 | — | — | US | disclosed |
| US-5231223-A | PROCESS FOR THE ARYLATION OF OLEFINS | BAYER AKTIENGESELLSCHAFT (DE) | 1993-07-27 | — | — | US | disclosed |