⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3277662 | 0.81 | CA1 (0.31) | — | |
| SCHEMBL305894 | 0.71 | TSHR (0.30) | — | |
| SCHEMBL6470170 | 0.67 | ADRB2 (0.30) | — | |
| SCHEMBL9782140 | 0.67 | TDP1 (0.35) | — | |
| SCHEMBL247142 | 0.67 | — | — | |
| Hydrogen Peroxide SCHEMBL9341267 | 0.64 | TSHR (0.46) | — | |
| Hydrogen Peroxide SCHEMBL27948378 | 0.64 | TSHR (0.46) | — | |
| SCHEMBL1657177 | 0.64 | CA1 (0.39) | — | |
| SCHEMBL3185706 | 0.64 | TSHR (0.33) | — | |
| SCHEMBL18411565 | 0.64 | LMNA (0.32) | — |
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-5906788-A | Dual cure, in-mold process for manufacturing abrasion resistant, coated thermoplastic articles | COOK COMPOSITES AND POLYMERS CO. (US) | 1999-05-25 | — | — | US | disclosed |
| WO-1995009724-A1 | DUAL CURE, IN-MOLD PROCESS FOR MANUFACTURING ABRASION RESISTANT, COATED THERMOPLASTIC ARTICLES | COOK COMPOSITES AND POLYMERS (US) | 1995-04-13 | — | — | WO | disclosed |