⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8159896 | 0.97 | TSHR (0.36) | — | |
| SCHEMBL6558593 | 0.97 | — | — | |
| SCHEMBL8958511 | 0.88 | — | — | |
| SCHEMBL2870119 | 0.88 | TSHR (0.33) | — | |
| SCHEMBL4407347 | 0.86 | ALDH1A1 (0.32) | — | |
| Methacrylic Acid SCHEMBL9151855 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL27670396 | 0.82 | CA2 (0.34) | — | |
| SCHEMBL598007 | 0.82 | L3MBTL1 (0.35) | — | |
| SCHEMBL10978672 | 0.82 | TSHR (0.36) | — | |
| Acrylamide SCHEMBL28270515 | 0.76 | TSHR (0.39) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6028028-A | LAMINATED STRUCTURE COMPRISING A PLAIN WEAVE FABRIC BONDED WITH AN ADHESIVE TO A WATERPROOF STRETCHED RESIN FILM COATED WITH IMAGE RECEIVING LAYER; INK JET, THERMAL OR LASER PRINTING PAPER WITH GOOD INK ABSORPTION AND SURFACE TOUGHNESS | OJI-YUKA SYNTHETIC PAPER CO., LTD. (JP) | 2000-02-22 | — | — | US | disclosed |