⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL237864 | 0.93 | — | — | |
| SCHEMBL235468 | 0.91 | — | — | |
| SCHEMBL5699016 | 0.83 | TSHR (0.32) | — | |
| SCHEMBL5698944 | 0.81 | TSHR (0.33) | — | |
| SCHEMBL237186 | 0.79 | — | — | |
| SCHEMBL9757137 | 0.79 | — | — | |
| SCHEMBL143880 | 0.78 | — | — | |
| SCHEMBL853988 | 0.77 | — | — | |
| SCHEMBL11766554 | 0.77 | — | — | |
| SCHEMBL80189 | 0.76 | — | — |
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-8865851-B2 | Moisture-curing coating compositions comprising aprotic solvents and binders having alkoxysilane groups and method of forming a multicoat finish therewith | BASF COATINGS GMBH (DE) | 2014-10-21 | — | — | US | disclosed |
| US-20120045586-A1 | MOISTURE-CURING COATING COMPOSITIONS BASED ON APROTIC SOLVENTS COMPRISING BINDERS HAVING ALKOXYSILANE GROUPS AND THE USE THEREOF | BASF COATINGS GMBH (DE) | 2012-02-23 | — | — | US | disclosed |