⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11283442 | 0.81 | RECQL (0.30) | — | |
| SCHEMBL19494859 | 0.79 | ALDH1A1 (0.40) | — | |
| SCHEMBL5270330 | 0.77 | — | — | |
| SCHEMBL9348089 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL15614014 | 0.74 | TDP1 (0.40) | — | |
| SCHEMBL329520 | 0.72 | — | — | |
| SCHEMBL50400 | 0.72 | ALDH1A1 (0.43) | — | |
| SCHEMBL1782791 | 0.72 | TGFBR1 (0.37) | — | |
| SCHEMBL8086434 | 0.72 | TSHR (0.53) | — | |
| SCHEMBL11650990 | 0.71 | GRIK1 (0.34) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0370646-B1 | Apparatus and method for the manufacture of absorbent materials | NIPPON CATALYTIC CHEM IND (JP) | 1994-08-03 | — | — | EP | disclosed |
| US-5079034-A | Good adhesion to substrate | NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) | 1992-01-07 | — | — | US | disclosed |
| EP-0370646-A2 | Apparatus and method for the manufacture of absorbent materials | NIPPON SHOKUBAI CO., LTD. (JP) | 1990-05-30 | — | — | EP | disclosed |