⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5526464 | 0.79 | — | — | |
| SCHEMBL20506248 | 0.76 | — | — | |
| SCHEMBL28630777 | 0.75 | CA12 (0.40) | — | |
| SCHEMBL1632731 | 0.74 | — | — | |
| SCHEMBL4222234 | 0.74 | — | — | |
| SCHEMBL3448389 | 0.69 | CHRM1 (0.36) | — | |
| SCHEMBL17704771 | 0.69 | CHRM1 (0.36) | — | |
| SCHEMBL1897691 | 0.69 | — | — | |
| SCHEMBL208061 | 0.69 | — | — | |
| SCHEMBL43188 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101163700-A | Triamine derivative | DAIICHI SEIYAKU CO (JP) | 2008-04-16 | — | — | CN | disclosed |
| US-20070219210-A1 | Amidopyrazole Derivative | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2007-09-20 | — | — | US | disclosed |
| EP-1698626-A1 | AMIDOPYRAZOLE DERIVATIVE | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-09-06 | — | — | EP | disclosed |