⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9487544 | 0.78 | — | — | |
| SCHEMBL8325255 | 0.74 | ALDH1A1 (0.48) | — | |
| SCHEMBL27870488 | 0.74 | CA5A (0.32) | — | |
| SCHEMBL10954682 | 0.72 | ALDH1A1 (0.46) | — | |
| SCHEMBL16554201 | 0.70 | — | — | |
| SCHEMBL151415 | 0.69 | — | — | |
| SCHEMBL11451161 | 0.69 | TSHR (0.39) | — | |
| SCHEMBL1173666 | 0.69 | DGAT1 (0.32) | — | |
| SCHEMBL1174173 | 0.69 | ALDH1A1 (0.47) | — | |
| SCHEMBL9542021 | 0.67 | TSHR (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1656188-A | In-mold appearance coatings for nylon and nylon based thermoplastic substrates | OMNOVA SOLUTIONS INC (US) | 2005-08-17 | — | — | CN | claimed |
| CN-1656188-A | In-mold appearance coatings for nylon and nylon based thermoplastic substrates | OMNOVA SOLUTIONS INC (US) | 2005-08-17 | — | — | CN | disclosed |