⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4661463 | 1.00 | — | — | |
| SCHEMBL4662729 | 0.95 | — | — | |
| SCHEMBL4664272 | 0.92 | — | — | |
| SCHEMBL28658877 | 0.76 | TSHR (0.33) | — | |
| SCHEMBL4355837 | 0.73 | EPHX1 (0.42) | — | |
| SCHEMBL19281470 | 0.73 | TSHR (0.34) | — | |
| SCHEMBL17800305 | 0.72 | MEN1 (0.44) | — | |
| SCHEMBL4310036 | 0.72 | TSHR (0.43) | — | |
| SCHEMBL29066700 | 0.71 | BLM (0.44) | — | |
| SCHEMBL4662722 | 0.71 | ALDH1A1 (0.33) | — |
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-9694565-B2 | Accelerated bonding of isocyanate functional adhesive to fiber reinforced plastics | DOW GLOBAL TECHNOLOGIES LLC (US) | 2017-07-04 | — | — | US | disclosed |
| US-20150225617-A1 | ACCELERATED BONDING OF ISOCYANATE FUNCTIONAL ADHESIVE TO FIBER REINFORCED PLASTICS | THE DOW CHEMICAL COMPANY | 2015-08-13 | — | — | US | disclosed |