⚠ 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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL9580757 | 0.82 | TSHR (0.39) | — | |
| SCHEMBL16912118 | 0.81 | TSHR (0.41) | — | |
| SCHEMBL11205414 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL9580717 | 0.77 | — | — | |
| SCHEMBL10359981 | 0.76 | — | — | |
| SCHEMBL142610 | 0.76 | TSHR (0.43) | — | |
| SCHEMBL22087942 | 0.76 | ALDH1A1 (0.46) | — | |
| SCHEMBL5597914 | 0.76 | ALDH1A1 (0.46) | — | |
| SCHEMBL20171909 | 0.76 | ALDH1A1 (0.46) | — | |
| SCHEMBL11294910 | 0.76 | ALDH1A1 (0.46) | — |
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-8530603-B2 | Golf ball | SRI SPORTS LIMITED (JP) | 2013-09-10 | — | — | US | disclosed |
| US-20100331113-A1 | GOLF BALL | SUMITOMO RUBBER INDUSTRIES, LTD. (JP) | 2010-12-30 | — | — | US | disclosed |