⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8901105 | 0.78 | — | — | |
| SCHEMBL6570658 | 0.77 | — | — | |
| SCHEMBL1050075 | 0.77 | — | — | |
| SCHEMBL6407067 | 0.74 | — | — | |
| SCHEMBL27736676 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL1334082 | 0.74 | TSHR (0.48) | — | |
| SCHEMBL14764019 | 0.74 | — | — | |
| SCHEMBL15542755 | 0.74 | — | — | |
| SCHEMBL15044047 | 0.72 | DPP4 (0.38) | — | |
| SCHEMBL3835641 | 0.72 | THRB (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009105083-A1 | A CRYSTALLINE POLYOLEFIN BLEND COMPRISING POLYHEDRAL OLIGOMERIC SILSESQUIOXANE NANOPARTICLES | UNIVERSITY OF AKRON (US) | 2009-08-27 | — | — | WO | claimed |
| WO-2009105083-A1 | A CRYSTALLINE POLYOLEFIN BLEND COMPRISING POLYHEDRAL OLIGOMERIC SILSESQUIOXANE NANOPARTICLES | UNIVERSITY OF AKRON (US) | 2009-08-27 | — | — | WO | disclosed |