⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2944946 | 0.75 | — | — | |
| SCHEMBL7781776 | 0.72 | — | — | |
| SCHEMBL228689 | 0.72 | — | — | |
| SCHEMBL514376 | 0.72 | — | — | |
| SCHEMBL10913891 | 0.67 | — | — | |
| Bromide SCHEMBL28549969 | 0.67 | — | — | |
| SCHEMBL10725904 | 0.67 | — | — | |
| SCHEMBL15167305 | 0.67 | — | — | |
| SCHEMBL10809981 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL28643337 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102666543-B | Inhibitors of diacylglycerol acyltransferase | LILLY CO ELI | 2014-12-24 | — | — | CN | disclosed |
| CN-102666543-A | Inhibitors of diacylglycerol acyltransferase | LILLY CO ELI | 2012-09-12 | — | — | CN | disclosed |
| CN-101765585-A | Antibacterial agent | ACHAOGEN INC | 2010-06-30 | — | — | CN | disclosed |
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |