⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17449766 | 0.97 | — | — | |
| SCHEMBL10901590 | 0.97 | ALDH1A1 (0.60) | — | |
| SCHEMBL1866106 | 0.97 | ALDH1A1 (0.60) | — | |
| SCHEMBL6115 | 0.97 | — | — | |
| SCHEMBL23930216 | 0.94 | — | — | |
| SCHEMBL11727701 | 0.94 | — | — | |
| Calcium SCHEMBL9066170 | 0.94 | — | — | |
| SCHEMBL22288371 | 0.94 | — | — | |
| SCHEMBL7960658 | 0.94 | — | — | |
| SCHEMBL1506867 | 0.94 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20100159128-A1 | Niobium 2-ethylhexanoate derivative, method of producing the derivative, organic acid metal salt composition containing the derivative, and method of producing thin film using the composition | YOSHINAKA ATSUYA | 2010-06-24 | — | — | US | disclosed |
| US-20090136658-A1 | Niobium 2-Ethylhexanoate Derivative, Method Of Producing The Derivative, Organic Acid Metal Salt Composition Containing The Derivative, And Method Of Producing Thin Film Using The Composition | ADEKA CORPORATION (JP) | 2009-05-28 | — | — | US | disclosed |
| US-4054480-A | AS A CATALYST, ACRYLIC POLYMERS | NATIONAL STARCH AND CHEMICAL CORPORATION (US) | 1977-10-18 | — | — | US | disclosed |
| US-3957561-A | Anaerobic adhesive and sealant compositions employing a two component catalyst system of diazosulfone and o-sulfobenzimide | NATIONAL STARCH AND CHEMICAL CORPORATION (US) | 1976-05-18 | — | — | US | disclosed |